NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
447098 |
2kom   |
16520 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kom
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 1308
_Distance_constraint_stats_list.Viol_count 2336
_Distance_constraint_stats_list.Viol_total 3019.637
_Distance_constraint_stats_list.Viol_max 0.491
_Distance_constraint_stats_list.Viol_rms 0.0244
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0058
_Distance_constraint_stats_list.Viol_average_violations_only 0.0646
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 26 LYS 0.837 0.158 5 0 "[ . 1 . 2]"
1 27 LYS 0.108 0.056 10 0 "[ . 1 . 2]"
1 29 GLY 0.851 0.176 10 0 "[ . 1 . 2]"
1 30 LYS 4.374 0.217 2 0 "[ . 1 . 2]"
1 31 ARG 3.553 0.126 2 0 "[ . 1 . 2]"
1 32 LEU 8.318 0.222 10 0 "[ . 1 . 2]"
1 33 ASN 1.986 0.163 9 0 "[ . 1 . 2]"
1 34 ILE 1.792 0.112 13 0 "[ . 1 . 2]"
1 35 GLN 1.979 0.150 15 0 "[ . 1 . 2]"
1 36 LEU 13.380 0.491 5 0 "[ . 1 . 2]"
1 37 LYS 6.762 0.269 16 0 "[ . 1 . 2]"
1 38 LYS 7.209 0.220 6 0 "[ . 1 . 2]"
1 39 GLY 0.377 0.070 2 0 "[ . 1 . 2]"
1 40 THR 0.281 0.082 4 0 "[ . 1 . 2]"
1 41 GLU 0.077 0.059 15 0 "[ . 1 . 2]"
1 42 GLY 0.204 0.082 4 0 "[ . 1 . 2]"
1 43 LEU 1.962 0.167 8 0 "[ . 1 . 2]"
1 44 GLY 0.022 0.014 16 0 "[ . 1 . 2]"
1 45 PHE 5.896 0.198 10 0 "[ . 1 . 2]"
1 46 SER 0.216 0.056 19 0 "[ . 1 . 2]"
1 47 ILE 5.844 0.254 8 0 "[ . 1 . 2]"
1 48 THR 1.207 0.124 18 0 "[ . 1 . 2]"
1 49 SER 0.845 0.096 3 0 "[ . 1 . 2]"
1 50 ARG 2.300 0.217 9 0 "[ . 1 . 2]"
1 51 ASP 0.540 0.140 16 0 "[ . 1 . 2]"
1 52 VAL 1.608 0.228 15 0 "[ . 1 . 2]"
1 53 THR 1.184 0.206 7 0 "[ . 1 . 2]"
1 54 ILE 1.315 0.206 7 0 "[ . 1 . 2]"
1 55 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLY 0.732 0.199 13 0 "[ . 1 . 2]"
1 57 SER 0.126 0.028 12 0 "[ . 1 . 2]"
1 58 ALA 2.241 0.199 13 0 "[ . 1 . 2]"
1 59 PRO 0.391 0.228 15 0 "[ . 1 . 2]"
1 60 ILE 0.940 0.078 3 0 "[ . 1 . 2]"
1 61 TYR 5.177 0.167 18 0 "[ . 1 . 2]"
1 62 VAL 0.979 0.082 11 0 "[ . 1 . 2]"
1 63 LYS 4.836 0.275 9 0 "[ . 1 . 2]"
1 64 ASN 4.056 0.105 11 0 "[ . 1 . 2]"
1 65 ILE 5.966 0.194 5 0 "[ . 1 . 2]"
1 66 LEU 1.535 0.101 5 0 "[ . 1 . 2]"
1 67 PRO 4.276 0.319 7 0 "[ . 1 . 2]"
1 68 ARG 7.779 0.217 7 0 "[ . 1 . 2]"
1 69 GLY 4.117 0.319 7 0 "[ . 1 . 2]"
1 70 ALA 3.725 0.243 9 0 "[ . 1 . 2]"
1 71 ALA 1.469 0.087 20 0 "[ . 1 . 2]"
1 72 ILE 10.357 0.217 7 0 "[ . 1 . 2]"
1 73 GLN 0.693 0.143 3 0 "[ . 1 . 2]"
1 74 ASP 1.806 0.143 4 0 "[ . 1 . 2]"
1 75 GLY 3.353 0.491 5 0 "[ . 1 . 2]"
1 76 ARG 0.955 0.143 4 0 "[ . 1 . 2]"
1 77 LEU 2.160 0.087 20 0 "[ . 1 . 2]"
1 78 LYS 1.865 0.199 6 0 "[ . 1 . 2]"
1 79 ALA 4.568 0.194 5 0 "[ . 1 . 2]"
1 80 GLY 0.388 0.052 16 0 "[ . 1 . 2]"
1 81 ASP 0.957 0.128 5 0 "[ . 1 . 2]"
1 82 ARG 5.218 0.272 9 0 "[ . 1 . 2]"
1 83 LEU 6.358 0.258 10 0 "[ . 1 . 2]"
1 84 ILE 4.300 0.225 20 0 "[ . 1 . 2]"
1 85 GLU 1.641 0.108 9 0 "[ . 1 . 2]"
1 86 VAL 6.805 0.180 4 0 "[ . 1 . 2]"
1 87 ASN 6.317 0.208 10 0 "[ . 1 . 2]"
1 88 GLY 0.053 0.043 8 0 "[ . 1 . 2]"
1 89 VAL 2.445 0.128 20 0 "[ . 1 . 2]"
1 90 ASP 3.114 0.164 8 0 "[ . 1 . 2]"
1 91 LEU 8.585 0.272 9 0 "[ . 1 . 2]"
1 92 VAL 3.328 0.187 5 0 "[ . 1 . 2]"
1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LYS 3.428 0.164 8 0 "[ . 1 . 2]"
1 95 SER 0.813 0.096 2 0 "[ . 1 . 2]"
1 96 GLN 3.516 0.156 2 0 "[ . 1 . 2]"
1 97 GLU 1.975 0.131 1 0 "[ . 1 . 2]"
1 98 GLU 2.115 0.101 13 0 "[ . 1 . 2]"
1 99 VAL 3.758 0.156 2 0 "[ . 1 . 2]"
1 100 VAL 7.628 0.131 1 0 "[ . 1 . 2]"
1 101 SER 2.287 0.118 20 0 "[ . 1 . 2]"
1 102 LEU 4.709 0.147 5 0 "[ . 1 . 2]"
1 103 LEU 4.256 0.162 19 0 "[ . 1 . 2]"
1 104 ARG 3.503 0.162 19 0 "[ . 1 . 2]"
1 105 SER 0.010 0.010 3 0 "[ . 1 . 2]"
1 106 THR 3.250 0.220 6 0 "[ . 1 . 2]"
1 107 LYS 2.883 0.228 1 0 "[ . 1 . 2]"
1 108 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 GLY 0.987 0.108 16 0 "[ . 1 . 2]"
1 111 THR 3.931 0.178 4 0 "[ . 1 . 2]"
1 112 VAL 6.871 0.174 19 0 "[ . 1 . 2]"
1 113 SER 2.453 0.138 14 0 "[ . 1 . 2]"
1 114 LEU 6.832 0.198 10 0 "[ . 1 . 2]"
1 115 LEU 4.860 0.222 10 0 "[ . 1 . 2]"
1 116 VAL 1.395 0.181 9 0 "[ . 1 . 2]"
1 117 PHE 0.671 0.088 12 0 "[ . 1 . 2]"
1 118 ARG 3.197 0.218 3 0 "[ . 1 . 2]"
1 119 GLN 1.498 0.121 17 0 "[ . 1 . 2]"
1 120 GLU 0.205 0.084 17 0 "[ . 1 . 2]"
1 121 ASP 0.205 0.084 17 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 26 LYS HA 1 26 LYS QE . . 4.420 4.319 3.821 4.578 0.158 5 0 "[ . 1 . 2]" 1
2 1 26 LYS QB 1 26 LYS QE . . 4.030 3.108 1.889 3.891 . 0 0 "[ . 1 . 2]" 1
3 1 27 LYS HA 1 27 LYS QE . . 5.340 4.516 2.765 5.396 0.056 10 0 "[ . 1 . 2]" 1
4 1 29 GLY H 1 30 LYS H . . 3.990 3.799 2.449 4.166 0.176 10 0 "[ . 1 . 2]" 1
5 1 29 GLY QA 1 117 PHE QD . . 4.240 4.043 3.679 4.328 0.088 12 0 "[ . 1 . 2]" 1
6 1 29 GLY QA 1 118 ARG H . . 4.990 4.332 4.089 4.998 0.008 3 0 "[ . 1 . 2]" 1
7 1 29 GLY QA 1 119 GLN HA . . 4.070 2.392 1.794 3.258 . 0 0 "[ . 1 . 2]" 1
8 1 29 GLY HA2 1 30 LYS H . . 3.490 2.235 2.089 2.469 . 0 0 "[ . 1 . 2]" 1
9 1 29 GLY HA2 1 117 PHE QE . . 4.470 3.929 2.987 4.492 0.022 4 0 "[ . 1 . 2]" 1
10 1 29 GLY HA3 1 30 LYS H . . 3.490 3.049 2.305 3.501 0.011 7 0 "[ . 1 . 2]" 1
11 1 29 GLY HA3 1 117 PHE QE . . 4.470 2.769 2.229 3.319 . 0 0 "[ . 1 . 2]" 1
12 1 30 LYS H 1 30 LYS QB . . 3.540 2.632 2.173 3.200 . 0 0 "[ . 1 . 2]" 1
13 1 30 LYS H 1 30 LYS QG . . 3.920 3.064 2.137 4.006 0.086 5 0 "[ . 1 . 2]" 1
14 1 30 LYS H 1 31 ARG H . . 4.320 4.363 4.274 4.425 0.105 6 0 "[ . 1 . 2]" 1
15 1 30 LYS H 1 118 ARG H . . 3.990 3.257 2.877 3.696 . 0 0 "[ . 1 . 2]" 1
16 1 30 LYS H 1 119 GLN HA . . 4.230 3.744 2.885 4.286 0.056 1 0 "[ . 1 . 2]" 1
17 1 30 LYS HA 1 30 LYS QE . . 4.300 3.667 1.798 4.361 0.061 9 0 "[ . 1 . 2]" 1
18 1 30 LYS QB 1 30 LYS QE . . 3.100 2.047 1.809 3.024 . 0 0 "[ . 1 . 2]" 1
19 1 30 LYS QB 1 30 LYS QG . . 2.310 2.055 1.995 2.096 . 0 0 "[ . 1 . 2]" 1
20 1 30 LYS QB 1 31 ARG H . . 3.800 2.770 2.174 3.801 0.001 18 0 "[ . 1 . 2]" 1
21 1 30 LYS QB 1 32 LEU MD2 . . 4.640 3.500 2.309 4.711 0.071 19 0 "[ . 1 . 2]" 1
22 1 30 LYS QD 1 32 LEU MD1 . . 4.310 3.155 2.429 4.332 0.022 7 0 "[ . 1 . 2]" 1
23 1 30 LYS QE 1 30 LYS QG . . 3.180 2.460 2.251 2.848 . 0 0 "[ . 1 . 2]" 1
24 1 30 LYS QE 1 32 LEU H . . 4.960 5.054 4.927 5.177 0.217 2 0 "[ . 1 . 2]" 1
25 1 30 LYS QG 1 31 ARG H . . 4.400 3.506 1.874 4.326 . 0 0 "[ . 1 . 2]" 1
26 1 30 LYS QG 1 32 LEU MD1 . . 3.950 3.311 2.102 4.070 0.120 2 0 "[ . 1 . 2]" 1
27 1 31 ARG H 1 31 ARG QB . . 3.320 2.506 2.424 2.708 . 0 0 "[ . 1 . 2]" 1
28 1 31 ARG H 1 31 ARG HD2 . . 5.240 4.782 4.016 5.156 . 0 0 "[ . 1 . 2]" 1
29 1 31 ARG H 1 31 ARG QD . . 4.410 4.333 3.827 4.496 0.086 14 0 "[ . 1 . 2]" 1
30 1 31 ARG H 1 31 ARG HD3 . . 5.240 5.020 4.820 5.259 0.019 11 0 "[ . 1 . 2]" 1
31 1 31 ARG H 1 31 ARG HG2 . . 5.150 3.742 3.469 4.100 . 0 0 "[ . 1 . 2]" 1
32 1 31 ARG H 1 31 ARG QG . . 4.310 2.645 2.339 3.077 . 0 0 "[ . 1 . 2]" 1
33 1 31 ARG H 1 31 ARG HG3 . . 5.150 2.705 2.371 3.180 . 0 0 "[ . 1 . 2]" 1
34 1 31 ARG H 1 32 LEU H . . 4.480 4.385 4.186 4.492 0.012 5 0 "[ . 1 . 2]" 1
35 1 31 ARG H 1 32 LEU MD1 . . 5.100 4.184 3.141 5.168 0.068 19 0 "[ . 1 . 2]" 1
36 1 31 ARG HA 1 31 ARG HD2 . . 5.500 4.405 4.048 4.697 . 0 0 "[ . 1 . 2]" 1
37 1 31 ARG HA 1 31 ARG HD3 . . 5.500 4.583 4.222 4.885 . 0 0 "[ . 1 . 2]" 1
38 1 31 ARG HA 1 31 ARG QG . . 3.640 2.443 2.354 2.554 . 0 0 "[ . 1 . 2]" 1
39 1 31 ARG HA 1 32 LEU H . . 3.050 2.177 2.027 2.373 . 0 0 "[ . 1 . 2]" 1
40 1 31 ARG HA 1 115 LEU QD . . 3.870 3.560 3.187 3.804 . 0 0 "[ . 1 . 2]" 1
41 1 31 ARG HA 1 116 VAL MG2 . . 4.450 4.005 3.665 4.152 . 0 0 "[ . 1 . 2]" 1
42 1 31 ARG HA 1 117 PHE HA . . 3.060 2.279 1.989 2.449 . 0 0 "[ . 1 . 2]" 1
43 1 31 ARG HA 1 117 PHE QD . . 3.860 3.517 3.168 3.907 0.047 15 0 "[ . 1 . 2]" 1
44 1 31 ARG HA 1 118 ARG H . . 3.480 3.357 2.913 3.533 0.053 2 0 "[ . 1 . 2]" 1
45 1 31 ARG QB 1 31 ARG QD . . 2.900 2.217 1.998 2.414 . 0 0 "[ . 1 . 2]" 1
46 1 31 ARG QB 1 31 ARG QG . . 2.360 2.079 2.052 2.092 . 0 0 "[ . 1 . 2]" 1
47 1 31 ARG QB 1 32 LEU H . . 3.820 2.844 2.588 3.076 . 0 0 "[ . 1 . 2]" 1
48 1 31 ARG QB 1 84 ILE QG . . 4.050 3.591 3.109 4.161 0.111 6 0 "[ . 1 . 2]" 1
49 1 31 ARG QB 1 115 LEU QD . . 3.080 1.953 1.746 2.218 . 0 0 "[ . 1 . 2]" 1
50 1 31 ARG QB 1 117 PHE HA . . 5.140 3.945 3.450 4.242 . 0 0 "[ . 1 . 2]" 1
51 1 31 ARG QB 1 117 PHE QD . . 4.250 4.013 3.816 4.257 0.007 9 0 "[ . 1 . 2]" 1
52 1 31 ARG HB2 1 31 ARG HD2 . . 3.830 2.845 2.312 3.349 . 0 0 "[ . 1 . 2]" 1
53 1 31 ARG HB2 1 31 ARG HD3 . . 3.830 3.432 2.941 3.767 . 0 0 "[ . 1 . 2]" 1
54 1 31 ARG HB2 1 115 LEU MD1 . . 5.500 3.043 2.560 4.566 . 0 0 "[ . 1 . 2]" 1
55 1 31 ARG HB2 1 115 LEU MD2 . . 5.500 3.477 2.450 4.249 . 0 0 "[ . 1 . 2]" 1
56 1 31 ARG HB3 1 31 ARG HD2 . . 3.830 2.656 2.310 3.043 . 0 0 "[ . 1 . 2]" 1
57 1 31 ARG HB3 1 31 ARG HD3 . . 3.830 3.159 2.338 3.705 . 0 0 "[ . 1 . 2]" 1
58 1 31 ARG HB3 1 115 LEU MD1 . . 5.500 2.164 1.834 3.920 . 0 0 "[ . 1 . 2]" 1
59 1 31 ARG HB3 1 115 LEU MD2 . . 5.500 2.702 1.857 3.314 . 0 0 "[ . 1 . 2]" 1
60 1 31 ARG QD 1 32 LEU H . . 4.870 4.911 4.750 4.996 0.126 2 0 "[ . 1 . 2]" 1
61 1 31 ARG QD 1 84 ILE MD . . 4.040 3.433 2.151 4.046 0.006 16 0 "[ . 1 . 2]" 1
62 1 31 ARG QD 1 84 ILE QG . . 4.140 2.631 2.009 4.164 0.024 6 0 "[ . 1 . 2]" 1
63 1 31 ARG QD 1 84 ILE MG . . 4.050 2.572 1.927 3.334 . 0 0 "[ . 1 . 2]" 1
64 1 31 ARG QD 1 115 LEU QD . . 3.570 2.158 1.868 2.679 . 0 0 "[ . 1 . 2]" 1
65 1 31 ARG HD2 1 84 ILE MD . . 4.640 4.168 3.376 4.712 0.072 10 0 "[ . 1 . 2]" 1
66 1 31 ARG HD2 1 84 ILE MG . . 4.880 3.192 2.394 4.882 0.002 6 0 "[ . 1 . 2]" 1
67 1 31 ARG HD3 1 84 ILE MD . . 4.640 3.778 2.170 4.564 . 0 0 "[ . 1 . 2]" 1
68 1 31 ARG HD3 1 84 ILE MG . . 4.880 3.092 1.940 4.065 . 0 0 "[ . 1 . 2]" 1
69 1 31 ARG QG 1 32 LEU H . . 4.130 4.034 3.897 4.208 0.078 6 0 "[ . 1 . 2]" 1
70 1 31 ARG QG 1 84 ILE MD . . 4.390 3.502 2.069 4.261 . 0 0 "[ . 1 . 2]" 1
71 1 31 ARG QG 1 84 ILE MG . . 4.580 3.984 3.319 4.488 . 0 0 "[ . 1 . 2]" 1
72 1 31 ARG QG 1 115 LEU QD . . 4.350 3.286 2.773 3.693 . 0 0 "[ . 1 . 2]" 1
73 1 31 ARG QG 1 117 PHE HA . . 4.490 2.920 2.626 3.292 . 0 0 "[ . 1 . 2]" 1
74 1 31 ARG QG 1 117 PHE QD . . 3.530 2.045 1.822 2.393 . 0 0 "[ . 1 . 2]" 1
75 1 31 ARG HG2 1 117 PHE QD . . 4.050 2.180 1.907 2.592 . 0 0 "[ . 1 . 2]" 1
76 1 31 ARG HG3 1 117 PHE QD . . 4.050 2.585 2.057 3.259 . 0 0 "[ . 1 . 2]" 1
77 1 32 LEU H 1 32 LEU HB2 . . 3.530 2.720 2.617 2.803 . 0 0 "[ . 1 . 2]" 1
78 1 32 LEU H 1 32 LEU MD1 . . 4.920 3.525 2.442 4.172 . 0 0 "[ . 1 . 2]" 1
79 1 32 LEU H 1 32 LEU MD2 . . 4.660 3.206 2.346 4.527 . 0 0 "[ . 1 . 2]" 1
80 1 32 LEU H 1 33 ASN H . . 4.520 4.279 4.151 4.368 . 0 0 "[ . 1 . 2]" 1
81 1 32 LEU H 1 115 LEU HA . . 4.250 3.950 3.744 4.064 . 0 0 "[ . 1 . 2]" 1
82 1 32 LEU H 1 115 LEU QB . . 4.940 5.070 4.923 5.162 0.222 10 0 "[ . 1 . 2]" 1
83 1 32 LEU H 1 116 VAL H . . 3.620 2.607 2.362 2.743 . 0 0 "[ . 1 . 2]" 1
84 1 32 LEU H 1 116 VAL HB . . 4.860 4.873 4.792 4.911 0.051 13 0 "[ . 1 . 2]" 1
85 1 32 LEU H 1 116 VAL MG2 . . 3.720 2.895 2.729 3.015 . 0 0 "[ . 1 . 2]" 1
86 1 32 LEU HA 1 32 LEU MD1 . . 4.070 2.330 1.944 3.015 . 0 0 "[ . 1 . 2]" 1
87 1 32 LEU HA 1 116 VAL MG2 . . 5.070 4.359 4.130 4.637 . 0 0 "[ . 1 . 2]" 1
88 1 32 LEU HB2 1 32 LEU MD1 . . 3.360 2.900 2.250 3.216 . 0 0 "[ . 1 . 2]" 1
89 1 32 LEU HB2 1 33 ASN H . . 4.010 4.021 3.800 4.173 0.163 9 0 "[ . 1 . 2]" 1
90 1 32 LEU HB2 1 116 VAL H . . 3.950 3.448 3.111 4.131 0.181 9 0 "[ . 1 . 2]" 1
91 1 32 LEU HB2 1 116 VAL MG2 . . 3.400 2.203 1.870 2.956 . 0 0 "[ . 1 . 2]" 1
92 1 32 LEU MD1 1 33 ASN H . . 4.430 3.791 2.680 4.577 0.147 11 0 "[ . 1 . 2]" 1
93 1 32 LEU MD2 1 118 ARG QD . . 4.400 3.464 1.993 4.437 0.037 16 0 "[ . 1 . 2]" 1
94 1 33 ASN H 1 33 ASN QB . . 3.650 2.886 2.358 3.138 . 0 0 "[ . 1 . 2]" 1
95 1 33 ASN H 1 34 ILE H . . 4.400 4.309 4.210 4.398 . 0 0 "[ . 1 . 2]" 1
96 1 33 ASN HA 1 34 ILE H . . 3.060 2.064 2.011 2.106 . 0 0 "[ . 1 . 2]" 1
97 1 33 ASN HA 1 34 ILE HB . . 5.230 4.370 4.215 4.500 . 0 0 "[ . 1 . 2]" 1
98 1 33 ASN HA 1 115 LEU HA . . 3.720 2.378 2.224 2.487 . 0 0 "[ . 1 . 2]" 1
99 1 33 ASN HA 1 115 LEU MD1 . . 4.880 3.317 2.458 4.884 0.004 18 0 "[ . 1 . 2]" 1
100 1 33 ASN HA 1 115 LEU QD . . 4.160 2.645 2.450 4.034 . 0 0 "[ . 1 . 2]" 1
101 1 33 ASN HA 1 115 LEU MD2 . . 4.880 4.167 2.494 4.944 0.064 19 0 "[ . 1 . 2]" 1
102 1 33 ASN HA 1 116 VAL H . . 3.760 3.726 3.600 3.827 0.067 3 0 "[ . 1 . 2]" 1
103 1 33 ASN QB 1 34 ILE H . . 3.840 3.310 3.166 3.834 . 0 0 "[ . 1 . 2]" 1
104 1 33 ASN QB 1 115 LEU QB . . 4.750 3.737 3.354 4.235 . 0 0 "[ . 1 . 2]" 1
105 1 33 ASN QB 1 115 LEU QD . . 3.790 2.389 1.993 3.514 . 0 0 "[ . 1 . 2]" 1
106 1 33 ASN HB2 1 34 ILE H . . 4.420 3.472 3.289 4.326 . 0 0 "[ . 1 . 2]" 1
107 1 33 ASN HB3 1 34 ILE H . . 4.420 4.204 4.040 4.298 . 0 0 "[ . 1 . 2]" 1
108 1 34 ILE H 1 34 ILE HB . . 3.570 2.527 2.446 2.624 . 0 0 "[ . 1 . 2]" 1
109 1 34 ILE H 1 34 ILE MD . . 4.360 3.984 3.874 4.078 . 0 0 "[ . 1 . 2]" 1
110 1 34 ILE H 1 34 ILE HG13 . . 4.000 2.759 2.589 2.940 . 0 0 "[ . 1 . 2]" 1
111 1 34 ILE H 1 34 ILE MG . . 3.820 3.782 3.726 3.831 0.011 8 0 "[ . 1 . 2]" 1
112 1 34 ILE H 1 35 GLN H . . 4.960 4.344 4.176 4.451 . 0 0 "[ . 1 . 2]" 1
113 1 34 ILE H 1 113 SER HA . . 4.380 4.262 3.892 4.448 0.068 18 0 "[ . 1 . 2]" 1
114 1 34 ILE H 1 114 LEU H . . 4.340 2.920 2.682 3.103 . 0 0 "[ . 1 . 2]" 1
115 1 34 ILE H 1 114 LEU HB2 . . 4.290 3.350 3.042 3.705 . 0 0 "[ . 1 . 2]" 1
116 1 34 ILE H 1 114 LEU HB3 . . 5.070 4.432 3.990 4.716 . 0 0 "[ . 1 . 2]" 1
117 1 34 ILE H 1 114 LEU QD . . 5.370 4.272 3.880 4.554 . 0 0 "[ . 1 . 2]" 1
118 1 34 ILE H 1 115 LEU HA . . 3.900 3.287 3.065 3.478 . 0 0 "[ . 1 . 2]" 1
119 1 34 ILE HA 1 34 ILE MD . . 4.710 3.856 3.814 3.904 . 0 0 "[ . 1 . 2]" 1
120 1 34 ILE HB 1 34 ILE MD . . 3.540 2.460 2.418 2.494 . 0 0 "[ . 1 . 2]" 1
121 1 34 ILE HB 1 35 GLN H . . 4.620 4.133 3.941 4.319 . 0 0 "[ . 1 . 2]" 1
122 1 34 ILE HB 1 114 LEU H . . 4.270 3.361 3.123 3.581 . 0 0 "[ . 1 . 2]" 1
123 1 34 ILE HB 1 114 LEU HA . . 4.830 4.887 4.820 4.942 0.112 13 0 "[ . 1 . 2]" 1
124 1 34 ILE HB 1 114 LEU HB2 . . 4.100 2.166 1.961 2.356 . 0 0 "[ . 1 . 2]" 1
125 1 34 ILE HB 1 114 LEU HB3 . . 4.800 3.543 3.155 3.919 . 0 0 "[ . 1 . 2]" 1
126 1 34 ILE MD 1 34 ILE MG . . 2.710 1.912 1.858 1.962 . 0 0 "[ . 1 . 2]" 1
127 1 34 ILE MD 1 76 ARG HB3 . . 4.830 3.233 2.278 4.178 . 0 0 "[ . 1 . 2]" 1
128 1 34 ILE MD 1 76 ARG QG . . 4.470 3.424 2.127 4.528 0.058 7 0 "[ . 1 . 2]" 1
129 1 34 ILE MD 1 77 LEU H . . 4.290 4.112 3.608 4.357 0.067 11 0 "[ . 1 . 2]" 1
130 1 34 ILE MD 1 77 LEU HA . . 4.030 2.751 2.237 3.427 . 0 0 "[ . 1 . 2]" 1
131 1 34 ILE MD 1 77 LEU QD . . 4.370 2.539 2.039 3.313 . 0 0 "[ . 1 . 2]" 1
132 1 34 ILE MD 1 78 LYS H . . 5.140 4.233 3.669 4.965 . 0 0 "[ . 1 . 2]" 1
133 1 34 ILE MD 1 114 LEU HB3 . . 5.170 4.039 3.672 4.343 . 0 0 "[ . 1 . 2]" 1
134 1 34 ILE HG13 1 34 ILE MG . . 3.360 3.197 3.182 3.225 . 0 0 "[ . 1 . 2]" 1
135 1 34 ILE HG13 1 115 LEU HA . . 4.960 4.286 4.068 4.531 . 0 0 "[ . 1 . 2]" 1
136 1 34 ILE HG13 1 116 VAL H . . 5.180 4.028 3.728 4.385 . 0 0 "[ . 1 . 2]" 1
137 1 34 ILE MG 1 35 GLN H . . 4.130 2.643 2.404 2.994 . 0 0 "[ . 1 . 2]" 1
138 1 34 ILE MG 1 36 LEU H . . 4.600 4.109 3.838 4.344 . 0 0 "[ . 1 . 2]" 1
139 1 34 ILE MG 1 36 LEU QD . . 3.000 1.915 1.805 2.436 . 0 0 "[ . 1 . 2]" 1
140 1 34 ILE MG 1 76 ARG H . . 4.650 4.107 3.512 4.675 0.025 13 0 "[ . 1 . 2]" 1
141 1 34 ILE MG 1 76 ARG HB2 . . 4.730 2.832 1.909 3.779 . 0 0 "[ . 1 . 2]" 1
142 1 34 ILE MG 1 76 ARG HB3 . . 4.510 2.323 1.918 2.829 . 0 0 "[ . 1 . 2]" 1
143 1 34 ILE MG 1 76 ARG QD . . 4.310 2.769 1.822 4.009 . 0 0 "[ . 1 . 2]" 1
144 1 34 ILE MG 1 76 ARG HE . . 5.030 3.613 2.631 4.993 . 0 0 "[ . 1 . 2]" 1
145 1 34 ILE MG 1 76 ARG QG . . 4.300 2.624 1.793 3.700 . 0 0 "[ . 1 . 2]" 1
146 1 34 ILE MG 1 77 LEU H . . 4.160 3.665 3.142 4.166 0.006 19 0 "[ . 1 . 2]" 1
147 1 34 ILE MG 1 77 LEU QD . . 5.090 3.231 2.520 4.307 . 0 0 "[ . 1 . 2]" 1
148 1 34 ILE MG 1 114 LEU H . . 4.490 4.028 3.667 4.404 . 0 0 "[ . 1 . 2]" 1
149 1 34 ILE MG 1 114 LEU HB2 . . 4.730 3.304 2.885 3.648 . 0 0 "[ . 1 . 2]" 1
150 1 35 GLN H 1 35 GLN HB2 . . 4.000 2.556 2.413 2.861 . 0 0 "[ . 1 . 2]" 1
151 1 35 GLN H 1 35 GLN QG . . 4.320 3.141 2.786 4.109 . 0 0 "[ . 1 . 2]" 1
152 1 35 GLN H 1 36 LEU H . . 5.360 4.373 4.253 4.478 . 0 0 "[ . 1 . 2]" 1
153 1 35 GLN H 1 36 LEU QD . . 5.440 3.659 3.204 4.773 . 0 0 "[ . 1 . 2]" 1
154 1 35 GLN HA 1 36 LEU H . . 3.110 2.078 2.018 2.174 . 0 0 "[ . 1 . 2]" 1
155 1 35 GLN HA 1 111 THR MG . . 4.690 3.465 3.248 4.556 . 0 0 "[ . 1 . 2]" 1
156 1 35 GLN HA 1 113 SER HA . . 3.890 2.449 2.221 2.570 . 0 0 "[ . 1 . 2]" 1
157 1 35 GLN HA 1 114 LEU H . . 3.810 3.151 2.919 3.333 . 0 0 "[ . 1 . 2]" 1
158 1 35 GLN HA 1 114 LEU HB2 . . 5.500 4.637 4.179 5.169 . 0 0 "[ . 1 . 2]" 1
159 1 35 GLN HB2 1 36 LEU H . . 4.870 4.241 4.135 4.427 . 0 0 "[ . 1 . 2]" 1
160 1 35 GLN HB2 1 113 SER HA . . 5.340 4.625 3.658 4.856 . 0 0 "[ . 1 . 2]" 1
161 1 35 GLN HB3 1 36 LEU H . . 4.100 3.218 3.005 3.922 . 0 0 "[ . 1 . 2]" 1
162 1 35 GLN HB3 1 111 THR HA . . 5.240 4.615 3.833 5.355 0.115 18 0 "[ . 1 . 2]" 1
163 1 35 GLN HB3 1 111 THR MG . . 3.560 1.978 1.774 3.359 . 0 0 "[ . 1 . 2]" 1
164 1 35 GLN QG 1 36 LEU H . . 4.160 3.692 2.914 3.821 . 0 0 "[ . 1 . 2]" 1
165 1 35 GLN QG 1 111 THR HB . . 4.430 4.253 2.056 4.502 0.072 1 0 "[ . 1 . 2]" 1
166 1 35 GLN QG 1 111 THR MG . . 3.690 2.979 2.247 3.782 0.092 9 0 "[ . 1 . 2]" 1
167 1 35 GLN QG 1 112 VAL H . . 4.830 4.465 3.233 4.758 . 0 0 "[ . 1 . 2]" 1
168 1 35 GLN QG 1 112 VAL HA . . 4.560 4.595 4.119 4.710 0.150 15 0 "[ . 1 . 2]" 1
169 1 35 GLN QG 1 113 SER HA . . 4.310 2.298 2.117 2.696 . 0 0 "[ . 1 . 2]" 1
170 1 35 GLN QG 1 114 LEU H . . 4.250 3.814 3.526 4.280 0.030 18 0 "[ . 1 . 2]" 1
171 1 36 LEU H 1 36 LEU HB2 . . 3.760 2.375 2.152 2.604 . 0 0 "[ . 1 . 2]" 1
172 1 36 LEU H 1 36 LEU QD . . 3.890 2.867 2.526 3.533 . 0 0 "[ . 1 . 2]" 1
173 1 36 LEU H 1 36 LEU HG . . 4.090 4.177 2.964 4.347 0.257 5 0 "[ . 1 . 2]" 1
174 1 36 LEU H 1 111 THR HB . . 5.240 5.287 4.625 5.418 0.178 4 0 "[ . 1 . 2]" 1
175 1 36 LEU H 1 111 THR MG . . 3.910 3.052 2.773 3.943 0.033 18 0 "[ . 1 . 2]" 1
176 1 36 LEU H 1 112 VAL H . . 3.620 2.716 2.492 2.898 . 0 0 "[ . 1 . 2]" 1
177 1 36 LEU H 1 112 VAL HB . . 4.680 3.450 3.042 4.512 . 0 0 "[ . 1 . 2]" 1
178 1 36 LEU H 1 112 VAL QG . . 3.940 3.769 2.599 3.953 0.013 13 0 "[ . 1 . 2]" 1
179 1 36 LEU H 1 113 SER HA . . 3.830 3.831 3.590 3.900 0.070 11 0 "[ . 1 . 2]" 1
180 1 36 LEU H 1 114 LEU MD1 . . 5.280 5.188 4.517 5.338 0.058 15 0 "[ . 1 . 2]" 1
181 1 36 LEU H 1 114 LEU MD2 . . 5.280 2.921 2.651 4.510 . 0 0 "[ . 1 . 2]" 1
182 1 36 LEU HA 1 36 LEU QD . . 3.290 2.135 1.925 2.890 . 0 0 "[ . 1 . 2]" 1
183 1 36 LEU HA 1 70 ALA MB . . 4.310 3.905 3.469 4.367 0.057 15 0 "[ . 1 . 2]" 1
184 1 36 LEU HB2 1 112 VAL H . . 3.690 3.671 3.498 3.835 0.145 20 0 "[ . 1 . 2]" 1
185 1 36 LEU HB2 1 112 VAL HB . . 4.180 3.122 2.817 4.253 0.073 7 0 "[ . 1 . 2]" 1
186 1 36 LEU HB2 1 112 VAL QG . . 3.630 3.619 1.933 3.804 0.174 19 0 "[ . 1 . 2]" 1
187 1 36 LEU HB2 1 114 LEU QD . . 2.980 2.453 1.978 2.968 . 0 0 "[ . 1 . 2]" 1
188 1 36 LEU HB3 1 36 LEU HG . . 2.530 2.441 2.319 2.877 0.347 1 0 "[ . 1 . 2]" 1
189 1 36 LEU HB3 1 37 LYS H . . 3.970 2.998 2.462 3.572 . 0 0 "[ . 1 . 2]" 1
190 1 36 LEU HB3 1 70 ALA MB . . 3.690 2.179 1.860 3.300 . 0 0 "[ . 1 . 2]" 1
191 1 36 LEU HB3 1 112 VAL H . . 4.700 4.326 3.065 4.728 0.028 1 0 "[ . 1 . 2]" 1
192 1 36 LEU HB3 1 112 VAL HB . . 4.530 4.156 2.451 4.644 0.114 7 0 "[ . 1 . 2]" 1
193 1 36 LEU QD 1 37 LYS H . . 3.750 3.279 2.746 3.848 0.098 20 0 "[ . 1 . 2]" 1
194 1 36 LEU QD 1 70 ALA H . . 4.380 4.511 4.089 4.623 0.243 9 0 "[ . 1 . 2]" 1
195 1 36 LEU QD 1 70 ALA HA . . 4.340 3.755 3.452 4.134 . 0 0 "[ . 1 . 2]" 1
196 1 36 LEU QD 1 70 ALA MB . . 3.180 2.389 1.964 2.648 . 0 0 "[ . 1 . 2]" 1
197 1 36 LEU QD 1 71 ALA H . . 4.020 3.197 2.871 3.349 . 0 0 "[ . 1 . 2]" 1
198 1 36 LEU QD 1 71 ALA HA . . 3.390 1.844 1.725 1.997 . 0 0 "[ . 1 . 2]" 1
199 1 36 LEU QD 1 73 GLN HB2 . . 4.750 4.412 3.778 4.801 0.051 5 0 "[ . 1 . 2]" 1
200 1 36 LEU QD 1 74 ASP H . . 4.560 3.100 2.772 3.704 . 0 0 "[ . 1 . 2]" 1
201 1 36 LEU QD 1 74 ASP QB . . 3.630 1.859 1.721 2.238 . 0 0 "[ . 1 . 2]" 1
202 1 36 LEU QD 1 75 GLY H . . 4.520 3.274 3.080 3.868 . 0 0 "[ . 1 . 2]" 1
203 1 36 LEU QD 1 75 GLY HA2 . . 4.730 4.528 4.196 5.221 0.491 5 0 "[ . 1 . 2]" 1
204 1 36 LEU QD 1 76 ARG H . . 4.180 3.071 2.605 3.673 . 0 0 "[ . 1 . 2]" 1
205 1 36 LEU QD 1 76 ARG QD . . 5.030 4.033 2.649 4.870 . 0 0 "[ . 1 . 2]" 1
206 1 36 LEU QD 1 77 LEU H . . 4.840 2.921 2.561 3.296 . 0 0 "[ . 1 . 2]" 1
207 1 36 LEU QD 1 77 LEU QD . . 3.770 2.593 2.056 3.659 . 0 0 "[ . 1 . 2]" 1
208 1 36 LEU QD 1 114 LEU H . . 4.510 4.052 3.379 4.613 0.103 15 0 "[ . 1 . 2]" 1
209 1 36 LEU QD 1 114 LEU HB2 . . 4.150 3.315 2.867 4.201 0.051 15 0 "[ . 1 . 2]" 1
210 1 36 LEU QD 1 114 LEU QD . . 2.950 1.890 1.777 2.219 . 0 0 "[ . 1 . 2]" 1
211 1 36 LEU QD 1 114 LEU HG . . 3.860 2.950 2.124 3.591 . 0 0 "[ . 1 . 2]" 1
212 1 37 LYS H 1 37 LYS HB2 . . 4.040 2.757 2.374 3.542 . 0 0 "[ . 1 . 2]" 1
213 1 37 LYS H 1 37 LYS QB . . 3.310 2.321 2.149 2.864 . 0 0 "[ . 1 . 2]" 1
214 1 37 LYS H 1 37 LYS HB3 . . 4.040 2.628 2.257 3.618 . 0 0 "[ . 1 . 2]" 1
215 1 37 LYS H 1 37 LYS QE . . 4.220 3.787 1.808 4.369 0.149 1 0 "[ . 1 . 2]" 1
216 1 37 LYS H 1 38 LYS H . . 4.000 4.177 4.123 4.215 0.215 14 0 "[ . 1 . 2]" 1
217 1 37 LYS H 1 70 ALA MB . . 4.230 3.197 2.790 3.589 . 0 0 "[ . 1 . 2]" 1
218 1 37 LYS HA 1 37 LYS QE . . 3.960 3.594 1.820 4.229 0.269 16 0 "[ . 1 . 2]" 1
219 1 37 LYS HA 1 38 LYS H . . 3.130 1.971 1.857 2.067 . 0 0 "[ . 1 . 2]" 1
220 1 37 LYS HA 1 111 THR HA . . 3.760 2.255 1.901 2.652 . 0 0 "[ . 1 . 2]" 1
221 1 37 LYS QB 1 37 LYS QE . . 2.770 2.046 1.723 2.815 0.045 18 0 "[ . 1 . 2]" 1
222 1 37 LYS QB 1 38 LYS H . . 4.010 3.460 2.816 3.767 . 0 0 "[ . 1 . 2]" 1
223 1 37 LYS QB 1 39 GLY H . . 5.290 4.758 3.908 5.336 0.046 1 0 "[ . 1 . 2]" 1
224 1 37 LYS QB 1 111 THR MG . . 3.870 3.024 2.142 3.919 0.049 19 0 "[ . 1 . 2]" 1
225 1 37 LYS QE 1 37 LYS QG . . 3.090 2.406 2.218 2.876 . 0 0 "[ . 1 . 2]" 1
226 1 37 LYS QE 1 38 LYS H . . 4.610 4.380 2.400 4.808 0.198 3 0 "[ . 1 . 2]" 1
227 1 37 LYS QG 1 38 LYS H . . 4.070 3.048 2.475 4.099 0.029 1 0 "[ . 1 . 2]" 1
228 1 38 LYS H 1 38 LYS QB . . 3.190 2.341 2.247 2.536 . 0 0 "[ . 1 . 2]" 1
229 1 38 LYS H 1 38 LYS QD . . 5.170 4.740 4.492 4.923 . 0 0 "[ . 1 . 2]" 1
230 1 38 LYS H 1 38 LYS QE . . 5.120 4.351 3.791 4.778 . 0 0 "[ . 1 . 2]" 1
231 1 38 LYS H 1 39 GLY H . . 4.590 4.277 3.988 4.513 . 0 0 "[ . 1 . 2]" 1
232 1 38 LYS H 1 43 LEU QD . . 4.820 4.142 3.556 4.744 . 0 0 "[ . 1 . 2]" 1
233 1 38 LYS H 1 106 THR MG . . 3.990 3.848 3.264 4.090 0.100 19 0 "[ . 1 . 2]" 1
234 1 38 LYS H 1 111 THR HA . . 4.160 3.308 2.931 3.757 . 0 0 "[ . 1 . 2]" 1
235 1 38 LYS HA 1 38 LYS QD . . 4.110 4.124 3.785 4.238 0.128 17 0 "[ . 1 . 2]" 1
236 1 38 LYS HA 1 38 LYS QE . . 5.080 4.293 3.849 4.705 . 0 0 "[ . 1 . 2]" 1
237 1 38 LYS HA 1 39 GLY H . . 3.190 2.152 2.043 2.277 . 0 0 "[ . 1 . 2]" 1
238 1 38 LYS HA 1 43 LEU QD . . 3.820 3.448 3.046 3.873 0.053 4 0 "[ . 1 . 2]" 1
239 1 38 LYS HA 1 70 ALA MB . . 4.390 2.610 2.074 3.129 . 0 0 "[ . 1 . 2]" 1
240 1 38 LYS QB 1 38 LYS QD . . 3.100 2.314 2.195 2.401 . 0 0 "[ . 1 . 2]" 1
241 1 38 LYS QB 1 38 LYS QE . . 2.910 2.035 1.865 2.181 . 0 0 "[ . 1 . 2]" 1
242 1 38 LYS QB 1 43 LEU QD . . 4.740 3.484 2.546 4.293 . 0 0 "[ . 1 . 2]" 1
243 1 38 LYS QB 1 70 ALA MB . . 4.650 4.186 3.667 4.564 . 0 0 "[ . 1 . 2]" 1
244 1 38 LYS QB 1 106 THR MG . . 3.060 2.262 1.816 3.280 0.220 6 0 "[ . 1 . 2]" 1
245 1 38 LYS QB 1 110 GLY H . . 5.280 4.980 4.553 5.333 0.053 2 0 "[ . 1 . 2]" 1
246 1 38 LYS QB 1 110 GLY QA . . 4.430 2.687 2.119 3.231 . 0 0 "[ . 1 . 2]" 1
247 1 38 LYS QD 1 38 LYS QE . . 2.330 2.057 1.954 2.110 . 0 0 "[ . 1 . 2]" 1
248 1 38 LYS QD 1 106 THR HB . . 4.140 3.557 2.505 4.258 0.118 13 0 "[ . 1 . 2]" 1
249 1 38 LYS QD 1 106 THR MG . . 3.580 2.677 1.940 3.699 0.119 7 0 "[ . 1 . 2]" 1
250 1 38 LYS QD 1 110 GLY QA . . 4.610 3.785 3.166 4.490 . 0 0 "[ . 1 . 2]" 1
251 1 38 LYS QE 1 38 LYS QG . . 3.120 2.465 2.237 2.876 . 0 0 "[ . 1 . 2]" 1
252 1 38 LYS QE 1 106 THR MG . . 3.330 2.500 1.797 3.352 0.022 10 0 "[ . 1 . 2]" 1
253 1 38 LYS QG 1 39 GLY H . . 4.470 3.435 2.862 4.261 . 0 0 "[ . 1 . 2]" 1
254 1 38 LYS QG 1 106 THR MG . . 3.550 3.210 1.912 3.615 0.065 20 0 "[ . 1 . 2]" 1
255 1 39 GLY H 1 43 LEU QD . . 4.890 4.754 4.394 4.960 0.070 2 0 "[ . 1 . 2]" 1
256 1 39 GLY H 1 70 ALA HA . . 3.910 3.111 2.286 3.947 0.037 8 0 "[ . 1 . 2]" 1
257 1 39 GLY H 1 70 ALA MB . . 3.330 2.829 2.350 3.346 0.016 2 0 "[ . 1 . 2]" 1
258 1 40 THR HA 1 40 THR MG . . 3.430 2.670 2.314 3.263 . 0 0 "[ . 1 . 2]" 1
259 1 40 THR HA 1 42 GLY H . . 4.590 4.392 3.958 4.672 0.082 4 0 "[ . 1 . 2]" 1
260 1 40 THR MG 1 41 GLU QG . . 4.700 3.227 2.000 4.759 0.059 15 0 "[ . 1 . 2]" 1
261 1 40 THR MG 1 42 GLY H . . 5.070 4.292 3.212 4.984 . 0 0 "[ . 1 . 2]" 1
262 1 41 GLU H 1 41 GLU QG . . 5.040 3.165 2.264 4.396 . 0 0 "[ . 1 . 2]" 1
263 1 41 GLU H 1 42 GLY H . . 5.130 2.271 1.841 3.576 . 0 0 "[ . 1 . 2]" 1
264 1 41 GLU H 1 69 GLY HA2 . . 4.440 2.632 1.870 4.112 . 0 0 "[ . 1 . 2]" 1
265 1 41 GLU HA 1 41 GLU HG2 . . 3.950 3.144 2.487 3.859 . 0 0 "[ . 1 . 2]" 1
266 1 41 GLU HA 1 41 GLU QG . . 3.400 2.728 2.373 3.070 . 0 0 "[ . 1 . 2]" 1
267 1 41 GLU HA 1 41 GLU HG3 . . 3.950 3.282 2.479 3.851 . 0 0 "[ . 1 . 2]" 1
268 1 41 GLU HA 1 69 GLY HA2 . . 5.380 4.477 4.072 5.181 . 0 0 "[ . 1 . 2]" 1
269 1 41 GLU QB 1 69 GLY HA2 . . 4.700 2.116 1.812 3.287 . 0 0 "[ . 1 . 2]" 1
270 1 41 GLU HB2 1 42 GLY H . . 5.110 3.593 2.532 4.547 . 0 0 "[ . 1 . 2]" 1
271 1 41 GLU HB3 1 42 GLY H . . 5.110 3.924 2.739 4.427 . 0 0 "[ . 1 . 2]" 1
272 1 41 GLU QG 1 42 GLY H . . 4.990 4.316 3.834 4.861 . 0 0 "[ . 1 . 2]" 1
273 1 42 GLY HA2 1 70 ALA H . . 4.370 3.072 2.574 3.449 . 0 0 "[ . 1 . 2]" 1
274 1 42 GLY HA2 1 70 ALA HA . . 5.040 3.615 3.393 3.802 . 0 0 "[ . 1 . 2]" 1
275 1 43 LEU HA 1 43 LEU MD1 . . 4.520 3.310 2.083 3.863 . 0 0 "[ . 1 . 2]" 1
276 1 43 LEU HA 1 43 LEU QD . . 3.290 2.238 1.978 2.813 . 0 0 "[ . 1 . 2]" 1
277 1 43 LEU HA 1 43 LEU MD2 . . 4.520 2.703 1.985 3.819 . 0 0 "[ . 1 . 2]" 1
278 1 43 LEU HA 1 45 PHE H . . 4.970 4.010 3.481 4.197 . 0 0 "[ . 1 . 2]" 1
279 1 43 LEU HA 1 70 ALA H . . 3.370 3.223 2.701 3.537 0.167 8 0 "[ . 1 . 2]" 1
280 1 43 LEU HA 1 70 ALA MB . . 3.020 2.159 1.903 3.036 0.016 1 0 "[ . 1 . 2]" 1
281 1 43 LEU HA 1 112 VAL QG . . 5.190 4.769 4.159 5.112 . 0 0 "[ . 1 . 2]" 1
282 1 43 LEU HB2 1 44 GLY H . . 4.890 4.387 4.254 4.515 . 0 0 "[ . 1 . 2]" 1
283 1 43 LEU HB2 1 45 PHE H . . 4.560 4.402 4.024 4.593 0.033 3 0 "[ . 1 . 2]" 1
284 1 43 LEU HB2 1 103 LEU MD1 . . 3.840 3.494 2.752 3.860 0.020 15 0 "[ . 1 . 2]" 1
285 1 43 LEU HB2 1 103 LEU QD . . 3.210 3.029 2.310 3.343 0.133 11 0 "[ . 1 . 2]" 1
286 1 43 LEU HB2 1 103 LEU MD2 . . 3.840 3.438 2.482 3.900 0.060 3 0 "[ . 1 . 2]" 1
287 1 43 LEU HB3 1 44 GLY H . . 5.330 3.718 3.410 4.070 . 0 0 "[ . 1 . 2]" 1
288 1 43 LEU HB3 1 45 PHE H . . 4.180 3.534 3.106 3.844 . 0 0 "[ . 1 . 2]" 1
289 1 43 LEU HB3 1 103 LEU QD . . 3.180 2.534 2.078 2.941 . 0 0 "[ . 1 . 2]" 1
290 1 43 LEU QD 1 70 ALA MB . . 2.960 2.421 2.116 2.775 . 0 0 "[ . 1 . 2]" 1
291 1 43 LEU QD 1 103 LEU HA . . 4.030 2.721 1.961 3.322 . 0 0 "[ . 1 . 2]" 1
292 1 43 LEU QD 1 103 LEU HB2 . . 4.170 3.815 3.143 4.226 0.056 16 0 "[ . 1 . 2]" 1
293 1 43 LEU QD 1 103 LEU HB3 . . 4.270 4.186 3.857 4.383 0.113 19 0 "[ . 1 . 2]" 1
294 1 43 LEU QD 1 103 LEU HG . . 4.030 2.316 1.822 2.741 . 0 0 "[ . 1 . 2]" 1
295 1 43 LEU QD 1 112 VAL HB . . 3.260 2.444 2.032 3.322 0.062 18 0 "[ . 1 . 2]" 1
296 1 43 LEU QD 1 112 VAL QG . . 2.470 1.685 1.617 1.770 . 0 0 "[ . 1 . 2]" 1
297 1 43 LEU MD1 1 112 VAL HB . . 3.840 3.230 2.058 3.853 0.013 15 0 "[ . 1 . 2]" 1
298 1 43 LEU MD2 1 112 VAL HB . . 3.840 2.754 2.052 3.703 . 0 0 "[ . 1 . 2]" 1
299 1 44 GLY H 1 45 PHE H . . 4.450 3.168 2.918 3.431 . 0 0 "[ . 1 . 2]" 1
300 1 44 GLY H 1 69 GLY HA3 . . 5.360 3.465 2.986 3.903 . 0 0 "[ . 1 . 2]" 1
301 1 44 GLY QA 1 66 LEU H . . 4.640 3.369 3.043 3.701 . 0 0 "[ . 1 . 2]" 1
302 1 44 GLY QA 1 66 LEU HB2 . . 4.450 2.217 1.950 2.599 . 0 0 "[ . 1 . 2]" 1
303 1 44 GLY QA 1 66 LEU HB3 . . 5.150 3.559 3.355 3.981 . 0 0 "[ . 1 . 2]" 1
304 1 44 GLY QA 1 66 LEU QD . . 3.840 2.235 1.903 2.729 . 0 0 "[ . 1 . 2]" 1
305 1 44 GLY QA 1 69 GLY HA2 . . 4.870 3.942 3.398 4.568 . 0 0 "[ . 1 . 2]" 1
306 1 44 GLY QA 1 69 GLY HA3 . . 4.890 2.365 1.855 3.099 . 0 0 "[ . 1 . 2]" 1
307 1 44 GLY QA 1 71 ALA H . . 4.210 3.224 2.597 3.959 . 0 0 "[ . 1 . 2]" 1
308 1 44 GLY QA 1 72 ILE H . . 5.170 4.513 3.714 5.184 0.014 16 0 "[ . 1 . 2]" 1
309 1 45 PHE H 1 45 PHE QD . . 3.940 2.738 2.254 3.097 . 0 0 "[ . 1 . 2]" 1
310 1 45 PHE H 1 46 SER H . . 4.820 4.187 4.051 4.277 . 0 0 "[ . 1 . 2]" 1
311 1 45 PHE H 1 65 ILE HA . . 4.830 4.892 4.723 4.964 0.134 16 0 "[ . 1 . 2]" 1
312 1 45 PHE H 1 71 ALA H . . 5.120 5.138 4.961 5.195 0.075 16 0 "[ . 1 . 2]" 1
313 1 45 PHE HA 1 45 PHE QD . . 3.790 3.734 3.709 3.773 . 0 0 "[ . 1 . 2]" 1
314 1 45 PHE HA 1 46 SER H . . 3.460 2.136 2.088 2.209 . 0 0 "[ . 1 . 2]" 1
315 1 45 PHE HA 1 64 ASN H . . 4.930 4.317 4.028 4.577 . 0 0 "[ . 1 . 2]" 1
316 1 45 PHE HA 1 65 ILE HA . . 3.430 2.480 2.313 2.696 . 0 0 "[ . 1 . 2]" 1
317 1 45 PHE HA 1 65 ILE MD . . 4.550 2.785 2.400 3.247 . 0 0 "[ . 1 . 2]" 1
318 1 45 PHE HA 1 66 LEU H . . 4.110 2.890 2.621 3.159 . 0 0 "[ . 1 . 2]" 1
319 1 45 PHE HA 1 66 LEU QD . . 4.150 2.768 2.302 3.921 . 0 0 "[ . 1 . 2]" 1
320 1 45 PHE HA 1 103 LEU QD . . 4.720 4.745 4.359 4.853 0.133 8 0 "[ . 1 . 2]" 1
321 1 45 PHE HB2 1 46 SER H . . 4.070 2.836 2.673 2.965 . 0 0 "[ . 1 . 2]" 1
322 1 45 PHE HB2 1 62 VAL QG . . 4.290 2.327 1.979 2.713 . 0 0 "[ . 1 . 2]" 1
323 1 45 PHE HB2 1 64 ASN H . . 5.370 4.575 4.267 4.841 . 0 0 "[ . 1 . 2]" 1
324 1 45 PHE HB2 1 65 ILE MD . . 4.140 2.420 2.072 2.685 . 0 0 "[ . 1 . 2]" 1
325 1 45 PHE HB2 1 71 ALA MB . . 5.210 4.131 3.825 4.628 . 0 0 "[ . 1 . 2]" 1
326 1 45 PHE HB2 1 77 LEU QD . . 5.300 3.070 2.673 3.321 . 0 0 "[ . 1 . 2]" 1
327 1 45 PHE HB3 1 46 SER H . . 4.120 3.876 3.744 4.035 . 0 0 "[ . 1 . 2]" 1
328 1 45 PHE HB3 1 65 ILE MD . . 3.960 2.004 1.883 2.217 . 0 0 "[ . 1 . 2]" 1
329 1 45 PHE HB3 1 65 ILE MG . . 4.960 3.742 3.416 4.109 . 0 0 "[ . 1 . 2]" 1
330 1 45 PHE HB3 1 66 LEU H . . 5.140 4.299 3.686 4.755 . 0 0 "[ . 1 . 2]" 1
331 1 45 PHE HB3 1 71 ALA MB . . 4.510 2.690 2.478 3.135 . 0 0 "[ . 1 . 2]" 1
332 1 45 PHE HB3 1 77 LEU QD . . 4.720 2.724 2.355 3.204 . 0 0 "[ . 1 . 2]" 1
333 1 45 PHE QD 1 46 SER H . . 4.350 4.104 3.835 4.266 . 0 0 "[ . 1 . 2]" 1
334 1 45 PHE QD 1 47 ILE MG . . 3.340 2.986 2.068 3.375 0.035 2 0 "[ . 1 . 2]" 1
335 1 45 PHE QD 1 65 ILE MD . . 4.200 3.624 3.496 3.820 . 0 0 "[ . 1 . 2]" 1
336 1 45 PHE QD 1 71 ALA H . . 4.620 3.735 2.881 4.600 . 0 0 "[ . 1 . 2]" 1
337 1 45 PHE QD 1 71 ALA MB . . 3.820 2.587 2.000 3.296 . 0 0 "[ . 1 . 2]" 1
338 1 45 PHE QD 1 77 LEU QD . . 3.760 2.714 2.623 2.818 . 0 0 "[ . 1 . 2]" 1
339 1 45 PHE QE 1 77 LEU QD . . 4.300 3.154 2.836 3.421 . 0 0 "[ . 1 . 2]" 1
340 1 45 PHE QE 1 114 LEU HA . . 5.180 5.310 5.239 5.378 0.198 10 0 "[ . 1 . 2]" 1
341 1 45 PHE HZ 1 77 LEU QD . . 4.180 3.777 3.275 4.215 0.035 13 0 "[ . 1 . 2]" 1
342 1 45 PHE HZ 1 112 VAL MG1 . . 5.330 3.231 2.383 3.848 . 0 0 "[ . 1 . 2]" 1
343 1 45 PHE HZ 1 112 VAL QG . . 4.290 3.163 2.367 3.769 . 0 0 "[ . 1 . 2]" 1
344 1 45 PHE HZ 1 112 VAL MG2 . . 5.330 4.609 3.764 5.389 0.059 13 0 "[ . 1 . 2]" 1
345 1 45 PHE HZ 1 114 LEU MD1 . . 4.080 2.131 1.820 3.575 . 0 0 "[ . 1 . 2]" 1
346 1 45 PHE HZ 1 114 LEU QD . . 3.510 1.942 1.816 2.218 . 0 0 "[ . 1 . 2]" 1
347 1 45 PHE HZ 1 114 LEU MD2 . . 4.080 2.827 1.970 4.098 0.018 19 0 "[ . 1 . 2]" 1
348 1 46 SER H 1 63 LYS H . . 4.690 3.791 3.634 4.001 . 0 0 "[ . 1 . 2]" 1
349 1 46 SER H 1 63 LYS HB3 . . 5.140 3.969 3.350 4.375 . 0 0 "[ . 1 . 2]" 1
350 1 46 SER H 1 64 ASN H . . 3.810 2.629 2.415 2.858 . 0 0 "[ . 1 . 2]" 1
351 1 46 SER H 1 64 ASN HB2 . . 5.200 4.776 3.584 5.232 0.032 15 0 "[ . 1 . 2]" 1
352 1 46 SER H 1 65 ILE HA . . 4.600 3.821 3.464 4.143 . 0 0 "[ . 1 . 2]" 1
353 1 46 SER H 1 65 ILE MD . . 4.970 3.742 3.428 4.100 . 0 0 "[ . 1 . 2]" 1
354 1 46 SER H 1 66 LEU H . . 4.960 4.478 4.014 4.872 . 0 0 "[ . 1 . 2]" 1
355 1 46 SER H 1 79 ALA MB . . 5.140 5.048 4.697 5.196 0.056 19 0 "[ . 1 . 2]" 1
356 1 46 SER HA 1 64 ASN H . . 4.920 4.667 4.478 4.862 . 0 0 "[ . 1 . 2]" 1
357 1 46 SER QB 1 47 ILE H . . 3.660 2.703 2.431 3.519 . 0 0 "[ . 1 . 2]" 1
358 1 46 SER QB 1 64 ASN H . . 4.720 2.890 2.154 3.914 . 0 0 "[ . 1 . 2]" 1
359 1 46 SER HB2 1 47 ILE H . . 4.280 3.488 2.461 4.046 . 0 0 "[ . 1 . 2]" 1
360 1 46 SER HB3 1 47 ILE H . . 4.280 3.081 2.495 3.867 . 0 0 "[ . 1 . 2]" 1
361 1 47 ILE H 1 47 ILE MD . . 4.620 3.729 3.583 3.859 . 0 0 "[ . 1 . 2]" 1
362 1 47 ILE H 1 47 ILE HG12 . . 4.620 2.098 1.925 2.312 . 0 0 "[ . 1 . 2]" 1
363 1 47 ILE H 1 47 ILE QG . . 3.880 2.020 1.862 2.174 . 0 0 "[ . 1 . 2]" 1
364 1 47 ILE H 1 47 ILE HG13 . . 4.620 2.647 2.476 2.766 . 0 0 "[ . 1 . 2]" 1
365 1 47 ILE H 1 47 ILE MG . . 4.370 3.109 2.946 3.249 . 0 0 "[ . 1 . 2]" 1
366 1 47 ILE H 1 63 LYS HB3 . . 5.050 4.094 3.524 4.579 . 0 0 "[ . 1 . 2]" 1
367 1 47 ILE H 1 100 VAL MG1 . . 3.950 3.727 3.280 3.967 0.017 14 0 "[ . 1 . 2]" 1
368 1 47 ILE HA 1 47 ILE MD . . 4.510 4.175 4.151 4.189 . 0 0 "[ . 1 . 2]" 1
369 1 47 ILE HA 1 48 THR H . . 3.500 2.244 2.188 2.290 . 0 0 "[ . 1 . 2]" 1
370 1 47 ILE HA 1 60 ILE MG . . 4.280 3.873 3.650 4.148 . 0 0 "[ . 1 . 2]" 1
371 1 47 ILE HA 1 62 VAL H . . 4.810 4.748 4.647 4.860 0.050 18 0 "[ . 1 . 2]" 1
372 1 47 ILE HA 1 62 VAL HA . . 4.040 2.487 2.248 2.689 . 0 0 "[ . 1 . 2]" 1
373 1 47 ILE HA 1 63 LYS H . . 3.740 2.330 2.087 2.631 . 0 0 "[ . 1 . 2]" 1
374 1 47 ILE HA 1 63 LYS HA . . 4.970 4.627 4.227 4.984 0.014 13 0 "[ . 1 . 2]" 1
375 1 47 ILE HA 1 63 LYS HB2 . . 4.680 3.438 2.935 3.961 . 0 0 "[ . 1 . 2]" 1
376 1 47 ILE HA 1 64 ASN H . . 4.770 4.410 4.139 4.773 0.003 15 0 "[ . 1 . 2]" 1
377 1 47 ILE HB 1 47 ILE MD . . 3.300 2.424 2.389 2.446 . 0 0 "[ . 1 . 2]" 1
378 1 47 ILE HB 1 48 THR H . . 3.600 2.524 2.401 2.657 . 0 0 "[ . 1 . 2]" 1
379 1 47 ILE HB 1 60 ILE MD . . 4.570 3.883 3.493 4.328 . 0 0 "[ . 1 . 2]" 1
380 1 47 ILE HB 1 60 ILE MG . . 3.710 2.158 1.957 2.415 . 0 0 "[ . 1 . 2]" 1
381 1 47 ILE HB 1 100 VAL MG1 . . 4.530 4.575 4.491 4.649 0.119 4 0 "[ . 1 . 2]" 1
382 1 47 ILE MD 1 47 ILE MG . . 2.590 1.963 1.905 2.029 . 0 0 "[ . 1 . 2]" 1
383 1 47 ILE MD 1 48 THR H . . 4.520 4.493 4.315 4.590 0.070 13 0 "[ . 1 . 2]" 1
384 1 47 ILE MD 1 96 GLN HA . . 3.780 3.119 2.564 3.551 . 0 0 "[ . 1 . 2]" 1
385 1 47 ILE MD 1 96 GLN HB2 . . 4.990 4.610 3.895 5.074 0.084 6 0 "[ . 1 . 2]" 1
386 1 47 ILE MD 1 96 GLN HB3 . . 4.990 4.200 2.890 5.072 0.082 14 0 "[ . 1 . 2]" 1
387 1 47 ILE MD 1 96 GLN HE21 . . 4.880 3.453 1.797 3.974 . 0 0 "[ . 1 . 2]" 1
388 1 47 ILE MD 1 96 GLN HE22 . . 4.880 3.586 2.484 4.918 0.038 12 0 "[ . 1 . 2]" 1
389 1 47 ILE MD 1 99 VAL H . . 4.800 4.066 3.852 4.236 . 0 0 "[ . 1 . 2]" 1
390 1 47 ILE MD 1 99 VAL HA . . 4.600 4.253 4.145 4.439 . 0 0 "[ . 1 . 2]" 1
391 1 47 ILE MD 1 99 VAL HB . . 3.630 2.121 1.982 2.240 . 0 0 "[ . 1 . 2]" 1
392 1 47 ILE MD 1 100 VAL H . . 4.740 3.013 2.891 3.135 . 0 0 "[ . 1 . 2]" 1
393 1 47 ILE QG 1 47 ILE MG . . 2.930 2.401 2.341 2.419 . 0 0 "[ . 1 . 2]" 1
394 1 47 ILE QG 1 96 GLN QE . . 4.160 2.948 1.753 3.506 . 0 0 "[ . 1 . 2]" 1
395 1 47 ILE QG 1 100 VAL MG1 . . 3.440 2.339 2.133 2.484 . 0 0 "[ . 1 . 2]" 1
396 1 47 ILE HG12 1 47 ILE MG . . 3.530 2.474 2.401 2.497 . 0 0 "[ . 1 . 2]" 1
397 1 47 ILE HG13 1 47 ILE MG . . 3.530 3.244 3.217 3.259 . 0 0 "[ . 1 . 2]" 1
398 1 47 ILE MG 1 48 THR H . . 3.720 3.386 3.268 3.486 . 0 0 "[ . 1 . 2]" 1
399 1 47 ILE MG 1 61 TYR H . . 3.880 3.930 3.911 3.950 0.070 12 0 "[ . 1 . 2]" 1
400 1 47 ILE MG 1 62 VAL H . . 4.340 4.223 3.995 4.377 0.037 2 0 "[ . 1 . 2]" 1
401 1 47 ILE MG 1 62 VAL HA . . 3.950 2.715 2.523 2.911 . 0 0 "[ . 1 . 2]" 1
402 1 47 ILE MG 1 63 LYS H . . 4.200 3.743 3.505 3.978 . 0 0 "[ . 1 . 2]" 1
403 1 47 ILE MG 1 83 LEU HA . . 5.050 5.165 5.090 5.304 0.254 8 0 "[ . 1 . 2]" 1
404 1 47 ILE MG 1 83 LEU HB3 . . 4.180 3.672 3.167 4.208 0.028 8 0 "[ . 1 . 2]" 1
405 1 47 ILE MG 1 99 VAL HB . . 4.390 4.373 4.034 4.459 0.069 13 0 "[ . 1 . 2]" 1
406 1 48 THR H 1 48 THR HB . . 4.200 3.269 3.174 3.376 . 0 0 "[ . 1 . 2]" 1
407 1 48 THR H 1 48 THR MG . . 3.710 2.291 2.191 2.410 . 0 0 "[ . 1 . 2]" 1
408 1 48 THR H 1 49 SER H . . 5.150 4.315 4.243 4.359 . 0 0 "[ . 1 . 2]" 1
409 1 48 THR H 1 60 ILE HA . . 5.120 4.364 4.136 4.543 . 0 0 "[ . 1 . 2]" 1
410 1 48 THR H 1 60 ILE MG . . 3.930 3.472 3.080 3.833 . 0 0 "[ . 1 . 2]" 1
411 1 48 THR H 1 61 TYR H . . 3.810 2.687 2.518 2.796 . 0 0 "[ . 1 . 2]" 1
412 1 48 THR H 1 61 TYR HB2 . . 4.680 3.615 3.409 3.825 . 0 0 "[ . 1 . 2]" 1
413 1 48 THR H 1 61 TYR QB . . 4.100 3.499 3.331 3.668 . 0 0 "[ . 1 . 2]" 1
414 1 48 THR H 1 61 TYR HB3 . . 4.680 4.675 4.520 4.721 0.041 4 0 "[ . 1 . 2]" 1
415 1 48 THR H 1 61 TYR QD . . 5.350 4.972 4.646 5.264 . 0 0 "[ . 1 . 2]" 1
416 1 48 THR H 1 63 LYS H . . 4.220 3.663 3.341 3.937 . 0 0 "[ . 1 . 2]" 1
417 1 48 THR H 1 63 LYS HA . . 5.020 4.645 4.195 5.064 0.044 5 0 "[ . 1 . 2]" 1
418 1 48 THR H 1 63 LYS HB3 . . 4.880 4.572 4.299 4.890 0.010 13 0 "[ . 1 . 2]" 1
419 1 48 THR HA 1 49 SER H . . 3.510 2.333 2.165 2.426 . 0 0 "[ . 1 . 2]" 1
420 1 48 THR HA 1 96 GLN QB . . 5.340 5.015 4.659 5.373 0.033 6 0 "[ . 1 . 2]" 1
421 1 48 THR HB 1 49 SER H . . 4.320 3.975 3.801 4.211 . 0 0 "[ . 1 . 2]" 1
422 1 48 THR HB 1 63 LYS HB2 . . 4.490 2.128 1.939 2.609 . 0 0 "[ . 1 . 2]" 1
423 1 48 THR HB 1 63 LYS HB3 . . 4.510 3.686 3.344 4.085 . 0 0 "[ . 1 . 2]" 1
424 1 48 THR HB 1 63 LYS QD . . 4.330 2.926 1.912 4.228 . 0 0 "[ . 1 . 2]" 1
425 1 48 THR HB 1 63 LYS QE . . 4.700 2.622 1.757 4.182 . 0 0 "[ . 1 . 2]" 1
426 1 48 THR MG 1 49 SER H . . 4.780 3.621 3.417 4.009 . 0 0 "[ . 1 . 2]" 1
427 1 48 THR MG 1 61 TYR H . . 4.300 3.304 3.047 3.587 . 0 0 "[ . 1 . 2]" 1
428 1 48 THR MG 1 61 TYR HB2 . . 4.700 2.249 1.935 2.584 . 0 0 "[ . 1 . 2]" 1
429 1 48 THR MG 1 61 TYR QB . . 3.950 2.212 1.909 2.529 . 0 0 "[ . 1 . 2]" 1
430 1 48 THR MG 1 61 TYR HB3 . . 4.700 3.307 2.920 3.625 . 0 0 "[ . 1 . 2]" 1
431 1 48 THR MG 1 61 TYR QD . . 4.590 3.311 2.649 3.790 . 0 0 "[ . 1 . 2]" 1
432 1 48 THR MG 1 62 VAL H . . 4.810 4.333 3.676 4.653 . 0 0 "[ . 1 . 2]" 1
433 1 48 THR MG 1 63 LYS H . . 4.660 3.366 3.151 3.566 . 0 0 "[ . 1 . 2]" 1
434 1 48 THR MG 1 63 LYS HA . . 4.120 2.582 2.234 3.072 . 0 0 "[ . 1 . 2]" 1
435 1 48 THR MG 1 63 LYS HB2 . . 3.480 2.410 2.032 3.122 . 0 0 "[ . 1 . 2]" 1
436 1 48 THR MG 1 63 LYS HB3 . . 4.260 3.779 3.509 4.227 . 0 0 "[ . 1 . 2]" 1
437 1 48 THR MG 1 63 LYS QD . . 4.170 3.467 1.873 4.294 0.124 18 0 "[ . 1 . 2]" 1
438 1 48 THR MG 1 64 ASN H . . 4.960 4.943 4.736 5.006 0.046 12 0 "[ . 1 . 2]" 1
439 1 49 SER HA 1 50 ARG H . . 3.510 2.238 2.129 2.346 . 0 0 "[ . 1 . 2]" 1
440 1 49 SER HA 1 58 ALA MB . . 5.210 4.269 3.655 4.827 . 0 0 "[ . 1 . 2]" 1
441 1 49 SER HA 1 60 ILE MD . . 4.740 3.792 2.957 4.726 . 0 0 "[ . 1 . 2]" 1
442 1 49 SER HA 1 61 TYR H . . 4.470 3.452 3.076 4.059 . 0 0 "[ . 1 . 2]" 1
443 1 49 SER HA 1 61 TYR QD . . 5.100 3.139 2.623 3.652 . 0 0 "[ . 1 . 2]" 1
444 1 49 SER HA 1 96 GLN HE21 . . 5.070 4.174 3.159 5.166 0.096 3 0 "[ . 1 . 2]" 1
445 1 49 SER HA 1 96 GLN QE . . 4.390 3.736 3.076 4.290 . 0 0 "[ . 1 . 2]" 1
446 1 49 SER HA 1 96 GLN HE22 . . 5.070 4.493 3.685 5.151 0.081 6 0 "[ . 1 . 2]" 1
447 1 49 SER QB 1 50 ARG H . . 3.800 3.110 2.619 3.710 . 0 0 "[ . 1 . 2]" 1
448 1 49 SER QB 1 58 ALA MB . . 3.190 2.425 1.920 3.280 0.090 11 0 "[ . 1 . 2]" 1
449 1 49 SER QB 1 60 ILE MD . . 3.360 2.444 1.907 3.297 . 0 0 "[ . 1 . 2]" 1
450 1 49 SER QB 1 60 ILE MG . . 5.220 3.913 3.106 4.755 . 0 0 "[ . 1 . 2]" 1
451 1 49 SER QB 1 61 TYR H . . 5.290 4.223 3.414 4.623 . 0 0 "[ . 1 . 2]" 1
452 1 49 SER QB 1 96 GLN QB . . 4.460 3.572 2.532 4.546 0.086 13 0 "[ . 1 . 2]" 1
453 1 49 SER QB 1 96 GLN QE . . 4.220 2.565 1.763 3.364 . 0 0 "[ . 1 . 2]" 1
454 1 49 SER QB 1 96 GLN QG . . 3.860 3.093 1.987 3.937 0.077 7 0 "[ . 1 . 2]" 1
455 1 49 SER HB2 1 50 ARG H . . 4.630 3.293 2.668 4.239 . 0 0 "[ . 1 . 2]" 1
456 1 49 SER HB2 1 60 ILE MD . . 4.070 3.311 2.027 4.148 0.078 3 0 "[ . 1 . 2]" 1
457 1 49 SER HB3 1 50 ARG H . . 4.630 4.059 3.303 4.326 . 0 0 "[ . 1 . 2]" 1
458 1 49 SER HB3 1 60 ILE MD . . 4.070 2.613 1.943 4.124 0.054 2 0 "[ . 1 . 2]" 1
459 1 50 ARG H 1 50 ARG QB . . 3.590 2.582 2.200 3.366 . 0 0 "[ . 1 . 2]" 1
460 1 50 ARG H 1 50 ARG QG . . 3.850 3.046 2.438 3.989 0.139 19 0 "[ . 1 . 2]" 1
461 1 50 ARG H 1 51 ASP H . . 4.060 2.932 1.695 4.200 0.140 16 0 "[ . 1 . 2]" 1
462 1 50 ARG H 1 58 ALA MB . . 4.540 4.040 3.259 4.657 0.117 13 0 "[ . 1 . 2]" 1
463 1 50 ARG H 1 61 TYR QD . . 4.670 3.261 2.405 4.555 . 0 0 "[ . 1 . 2]" 1
464 1 50 ARG HA 1 50 ARG HD2 . . 4.680 3.873 2.168 4.718 0.038 19 0 "[ . 1 . 2]" 1
465 1 50 ARG HA 1 50 ARG QD . . 3.830 3.262 1.908 4.047 0.217 9 0 "[ . 1 . 2]" 1
466 1 50 ARG HA 1 50 ARG HD3 . . 4.680 3.675 1.939 4.709 0.029 3 0 "[ . 1 . 2]" 1
467 1 50 ARG QB 1 51 ASP H . . 4.270 2.657 1.789 3.965 . 0 0 "[ . 1 . 2]" 1
468 1 50 ARG HB2 1 51 ASP H . . 4.920 3.194 1.944 4.464 . 0 0 "[ . 1 . 2]" 1
469 1 50 ARG HB3 1 51 ASP H . . 4.920 3.211 1.801 4.437 . 0 0 "[ . 1 . 2]" 1
470 1 50 ARG QG 1 51 ASP H . . 4.930 3.892 2.971 4.701 . 0 0 "[ . 1 . 2]" 1
471 1 51 ASP H 1 52 VAL H . . 4.900 4.089 2.272 4.617 . 0 0 "[ . 1 . 2]" 1
472 1 51 ASP HA 1 52 VAL H . . 3.540 2.376 2.085 3.208 . 0 0 "[ . 1 . 2]" 1
473 1 51 ASP HB2 1 52 VAL H . . 4.580 3.939 2.995 4.539 . 0 0 "[ . 1 . 2]" 1
474 1 51 ASP HB3 1 52 VAL H . . 4.580 3.692 2.646 4.483 . 0 0 "[ . 1 . 2]" 1
475 1 52 VAL H 1 52 VAL HB . . 3.960 2.823 2.554 3.682 . 0 0 "[ . 1 . 2]" 1
476 1 52 VAL H 1 52 VAL QG . . 3.630 2.026 1.827 2.337 . 0 0 "[ . 1 . 2]" 1
477 1 52 VAL H 1 53 THR H . . 4.700 3.813 1.602 4.554 . 0 0 "[ . 1 . 2]" 1
478 1 52 VAL H 1 58 ALA HA . . 3.770 3.556 2.198 3.918 0.148 6 0 "[ . 1 . 2]" 1
479 1 52 VAL H 1 59 PRO QD . . 4.230 3.606 3.045 4.115 . 0 0 "[ . 1 . 2]" 1
480 1 52 VAL HA 1 52 VAL QG . . 3.050 2.331 2.182 2.398 . 0 0 "[ . 1 . 2]" 1
481 1 52 VAL HA 1 58 ALA HA . . 4.030 3.319 1.957 4.132 0.102 7 0 "[ . 1 . 2]" 1
482 1 52 VAL HA 1 58 ALA MB . . 4.940 4.369 3.377 5.025 0.085 11 0 "[ . 1 . 2]" 1
483 1 52 VAL HB 1 53 THR H . . 5.050 4.216 3.028 4.478 . 0 0 "[ . 1 . 2]" 1
484 1 52 VAL HB 1 59 PRO QD . . 3.600 2.922 1.877 3.828 0.228 15 0 "[ . 1 . 2]" 1
485 1 52 VAL QG 1 53 THR H . . 4.910 2.909 2.466 3.428 . 0 0 "[ . 1 . 2]" 1
486 1 52 VAL QG 1 54 ILE H . . 4.350 2.981 1.715 4.405 0.055 8 0 "[ . 1 . 2]" 1
487 1 52 VAL QG 1 55 GLY QA . . 5.280 3.068 2.019 4.906 . 0 0 "[ . 1 . 2]" 1
488 1 52 VAL QG 1 56 GLY QA . . 4.490 3.134 1.906 4.519 0.029 14 0 "[ . 1 . 2]" 1
489 1 52 VAL QG 1 57 SER QB . . 4.640 3.988 2.930 4.655 0.015 15 0 "[ . 1 . 2]" 1
490 1 52 VAL QG 1 58 ALA H . . 4.870 2.942 1.694 4.553 . 0 0 "[ . 1 . 2]" 1
491 1 52 VAL QG 1 58 ALA HA . . 4.400 2.850 1.882 4.425 0.025 8 0 "[ . 1 . 2]" 1
492 1 52 VAL QG 1 59 PRO QD . . 4.550 2.845 1.744 3.757 . 0 0 "[ . 1 . 2]" 1
493 1 53 THR H 1 53 THR MG . . 4.730 3.085 2.069 3.984 . 0 0 "[ . 1 . 2]" 1
494 1 53 THR HA 1 53 THR MG . . 3.700 2.558 2.244 3.248 . 0 0 "[ . 1 . 2]" 1
495 1 53 THR HA 1 54 ILE H . . 3.140 2.750 2.031 3.346 0.206 7 0 "[ . 1 . 2]" 1
496 1 53 THR MG 1 54 ILE H . . 4.020 3.675 2.951 4.116 0.096 17 0 "[ . 1 . 2]" 1
497 1 54 ILE H 1 54 ILE MD . . 5.010 3.803 2.039 5.087 0.077 2 0 "[ . 1 . 2]" 1
498 1 56 GLY H 1 58 ALA H . . 4.590 4.387 3.313 4.789 0.199 13 0 "[ . 1 . 2]" 1
499 1 56 GLY QA 1 58 ALA H . . 4.340 3.923 3.389 4.381 0.041 18 0 "[ . 1 . 2]" 1
500 1 57 SER H 1 58 ALA H . . 4.760 3.179 1.656 4.002 . 0 0 "[ . 1 . 2]" 1
501 1 57 SER HA 1 58 ALA H . . 3.540 3.038 2.111 3.568 0.028 12 0 "[ . 1 . 2]" 1
502 1 57 SER QB 1 58 ALA H . . 4.070 3.029 2.157 4.004 . 0 0 "[ . 1 . 2]" 1
503 1 58 ALA H 1 58 ALA MB . . 3.570 2.747 2.218 3.049 . 0 0 "[ . 1 . 2]" 1
504 1 58 ALA HA 1 59 PRO QD . . 3.130 1.941 1.825 2.083 . 0 0 "[ . 1 . 2]" 1
505 1 58 ALA MB 1 59 PRO QD . . 3.530 2.964 2.206 3.485 . 0 0 "[ . 1 . 2]" 1
506 1 59 PRO HA 1 60 ILE H . . 3.180 2.176 2.108 2.286 . 0 0 "[ . 1 . 2]" 1
507 1 59 PRO HA 1 60 ILE MD . . 4.970 4.081 3.634 4.272 . 0 0 "[ . 1 . 2]" 1
508 1 59 PRO HA 1 60 ILE QG . . 4.210 3.446 3.286 3.568 . 0 0 "[ . 1 . 2]" 1
509 1 59 PRO QB 1 61 TYR QE . . 4.310 2.557 1.971 3.180 . 0 0 "[ . 1 . 2]" 1
510 1 59 PRO QB 1 82 ARG QD . . 5.110 2.978 2.004 4.663 . 0 0 "[ . 1 . 2]" 1
511 1 59 PRO QB 1 82 ARG QG . . 4.660 3.155 2.560 4.308 . 0 0 "[ . 1 . 2]" 1
512 1 59 PRO HB2 1 60 ILE H . . 4.540 3.456 3.056 3.797 . 0 0 "[ . 1 . 2]" 1
513 1 59 PRO HB2 1 61 TYR QE . . 5.150 2.594 1.980 3.268 . 0 0 "[ . 1 . 2]" 1
514 1 59 PRO HB3 1 60 ILE H . . 4.540 3.602 2.967 3.950 . 0 0 "[ . 1 . 2]" 1
515 1 59 PRO HB3 1 61 TYR QE . . 5.150 3.960 3.572 4.438 . 0 0 "[ . 1 . 2]" 1
516 1 60 ILE H 1 60 ILE HB . . 3.400 2.509 2.443 2.593 . 0 0 "[ . 1 . 2]" 1
517 1 60 ILE H 1 60 ILE MD . . 4.130 3.336 3.035 3.527 . 0 0 "[ . 1 . 2]" 1
518 1 60 ILE H 1 60 ILE QG . . 4.500 2.314 2.099 2.551 . 0 0 "[ . 1 . 2]" 1
519 1 60 ILE H 1 60 ILE MG . . 4.500 3.764 3.727 3.812 . 0 0 "[ . 1 . 2]" 1
520 1 60 ILE H 1 82 ARG QG . . 4.350 3.458 3.159 3.830 . 0 0 "[ . 1 . 2]" 1
521 1 60 ILE HA 1 60 ILE MD . . 4.160 2.196 2.109 2.302 . 0 0 "[ . 1 . 2]" 1
522 1 60 ILE HA 1 60 ILE MG . . 3.230 2.375 2.312 2.412 . 0 0 "[ . 1 . 2]" 1
523 1 60 ILE HA 1 61 TYR H . . 3.470 2.228 2.190 2.300 . 0 0 "[ . 1 . 2]" 1
524 1 60 ILE HB 1 61 TYR H . . 5.230 4.100 3.876 4.298 . 0 0 "[ . 1 . 2]" 1
525 1 60 ILE HB 1 83 LEU H . . 4.120 3.507 3.161 4.067 . 0 0 "[ . 1 . 2]" 1
526 1 60 ILE HB 1 83 LEU HB3 . . 3.930 2.869 2.253 3.904 . 0 0 "[ . 1 . 2]" 1
527 1 60 ILE HB 1 99 VAL QG . . 4.110 3.840 3.469 4.118 0.008 13 0 "[ . 1 . 2]" 1
528 1 60 ILE MD 1 60 ILE MG . . 2.820 2.046 1.973 2.133 . 0 0 "[ . 1 . 2]" 1
529 1 60 ILE MD 1 61 TYR H . . 4.360 3.933 3.744 4.150 . 0 0 "[ . 1 . 2]" 1
530 1 60 ILE MD 1 95 SER HA . . 4.440 4.053 3.522 4.482 0.042 10 0 "[ . 1 . 2]" 1
531 1 60 ILE MD 1 96 GLN H . . 5.090 3.637 3.083 4.248 . 0 0 "[ . 1 . 2]" 1
532 1 60 ILE MD 1 96 GLN QB . . 3.990 3.365 2.586 4.029 0.039 15 0 "[ . 1 . 2]" 1
533 1 60 ILE MD 1 96 GLN QG . . 4.810 2.729 1.986 3.869 . 0 0 "[ . 1 . 2]" 1
534 1 60 ILE MD 1 99 VAL H . . 4.910 4.843 4.457 4.978 0.068 14 0 "[ . 1 . 2]" 1
535 1 60 ILE MD 1 99 VAL QG . . 3.260 2.603 2.253 2.896 . 0 0 "[ . 1 . 2]" 1
536 1 60 ILE QG 1 60 ILE MG . . 3.240 2.281 2.215 2.311 . 0 0 "[ . 1 . 2]" 1
537 1 60 ILE QG 1 91 LEU HA . . 4.540 3.915 3.603 4.137 . 0 0 "[ . 1 . 2]" 1
538 1 60 ILE QG 1 92 VAL H . . 4.590 4.471 3.793 4.660 0.070 17 0 "[ . 1 . 2]" 1
539 1 60 ILE MG 1 61 TYR H . . 3.770 2.664 2.336 2.971 . 0 0 "[ . 1 . 2]" 1
540 1 60 ILE MG 1 83 LEU HB2 . . 3.620 2.607 2.097 3.447 . 0 0 "[ . 1 . 2]" 1
541 1 60 ILE MG 1 96 GLN HA . . 4.120 3.957 3.396 4.141 0.021 8 0 "[ . 1 . 2]" 1
542 1 60 ILE MG 1 99 VAL HB . . 4.470 3.668 3.287 3.904 . 0 0 "[ . 1 . 2]" 1
543 1 60 ILE MG 1 99 VAL QG . . 2.990 2.340 1.955 2.588 . 0 0 "[ . 1 . 2]" 1
544 1 61 TYR H 1 61 TYR QD . . 3.990 3.304 3.044 3.522 . 0 0 "[ . 1 . 2]" 1
545 1 61 TYR H 1 96 GLN QE . . 4.510 3.798 3.009 4.563 0.053 9 0 "[ . 1 . 2]" 1
546 1 61 TYR HA 1 62 VAL H . . 3.430 2.284 2.188 2.410 . 0 0 "[ . 1 . 2]" 1
547 1 61 TYR HA 1 62 VAL QG . . 4.610 3.500 3.375 3.593 . 0 0 "[ . 1 . 2]" 1
548 1 61 TYR HA 1 83 LEU H . . 3.960 2.486 2.164 2.716 . 0 0 "[ . 1 . 2]" 1
549 1 61 TYR QB 1 62 VAL H . . 3.560 2.588 2.400 2.737 . 0 0 "[ . 1 . 2]" 1
550 1 61 TYR QB 1 83 LEU H . . 4.710 4.553 4.247 4.742 0.032 13 0 "[ . 1 . 2]" 1
551 1 61 TYR HB2 1 62 VAL H . . 4.100 3.799 3.593 3.917 . 0 0 "[ . 1 . 2]" 1
552 1 61 TYR HB3 1 62 VAL H . . 4.100 2.634 2.438 2.798 . 0 0 "[ . 1 . 2]" 1
553 1 61 TYR QD 1 62 VAL H . . 4.300 3.579 3.357 3.837 . 0 0 "[ . 1 . 2]" 1
554 1 61 TYR QE 1 82 ARG HB2 . . 3.370 1.894 1.802 2.119 . 0 0 "[ . 1 . 2]" 1
555 1 61 TYR QE 1 82 ARG HB3 . . 3.430 3.505 3.460 3.571 0.141 15 0 "[ . 1 . 2]" 1
556 1 61 TYR QE 1 82 ARG HG2 . . 4.170 4.165 3.135 4.337 0.167 18 0 "[ . 1 . 2]" 1
557 1 61 TYR QE 1 82 ARG QG . . 3.640 2.922 2.422 3.262 . 0 0 "[ . 1 . 2]" 1
558 1 61 TYR QE 1 82 ARG HG3 . . 4.170 2.989 2.520 3.396 . 0 0 "[ . 1 . 2]" 1
559 1 61 TYR QE 1 83 LEU H . . 5.090 5.120 4.986 5.201 0.111 20 0 "[ . 1 . 2]" 1
560 1 62 VAL H 1 62 VAL HB . . 3.640 2.617 2.547 2.790 . 0 0 "[ . 1 . 2]" 1
561 1 62 VAL H 1 62 VAL QG . . 3.290 2.111 2.014 2.247 . 0 0 "[ . 1 . 2]" 1
562 1 62 VAL H 1 79 ALA HA . . 5.090 4.730 4.486 5.015 . 0 0 "[ . 1 . 2]" 1
563 1 62 VAL H 1 81 ASP H . . 4.480 3.542 2.629 4.261 . 0 0 "[ . 1 . 2]" 1
564 1 62 VAL H 1 83 LEU QD . . 4.730 3.795 2.769 4.752 0.022 5 0 "[ . 1 . 2]" 1
565 1 62 VAL HA 1 63 LYS H . . 3.360 2.088 2.032 2.136 . 0 0 "[ . 1 . 2]" 1
566 1 62 VAL HA 1 64 ASN H . . 4.240 4.117 3.885 4.292 0.052 3 0 "[ . 1 . 2]" 1
567 1 62 VAL HB 1 63 LYS H . . 5.000 4.114 3.973 4.201 . 0 0 "[ . 1 . 2]" 1
568 1 62 VAL HB 1 64 ASN H . . 5.210 5.160 4.854 5.257 0.047 8 0 "[ . 1 . 2]" 1
569 1 62 VAL HB 1 79 ALA H . . 5.220 5.011 4.719 5.222 0.002 20 0 "[ . 1 . 2]" 1
570 1 62 VAL HB 1 79 ALA HA . . 4.510 2.193 2.031 2.480 . 0 0 "[ . 1 . 2]" 1
571 1 62 VAL HB 1 80 GLY H . . 4.040 2.404 1.779 3.830 . 0 0 "[ . 1 . 2]" 1
572 1 62 VAL QG 1 63 LYS H . . 3.760 2.733 2.591 2.843 . 0 0 "[ . 1 . 2]" 1
573 1 62 VAL QG 1 65 ILE MD . . 3.190 2.069 1.929 2.305 . 0 0 "[ . 1 . 2]" 1
574 1 62 VAL QG 1 77 LEU QD . . 3.390 2.261 1.836 2.688 . 0 0 "[ . 1 . 2]" 1
575 1 62 VAL QG 1 77 LEU HG . . 3.520 3.035 2.636 3.434 . 0 0 "[ . 1 . 2]" 1
576 1 62 VAL QG 1 78 LYS H . . 4.050 3.860 3.599 4.072 0.022 12 0 "[ . 1 . 2]" 1
577 1 62 VAL QG 1 79 ALA H . . 4.520 3.795 3.592 4.127 . 0 0 "[ . 1 . 2]" 1
578 1 62 VAL QG 1 79 ALA HA . . 3.500 2.031 1.852 2.232 . 0 0 "[ . 1 . 2]" 1
579 1 62 VAL QG 1 79 ALA MB . . 3.900 2.459 2.185 2.749 . 0 0 "[ . 1 . 2]" 1
580 1 62 VAL QG 1 80 GLY H . . 3.860 3.068 2.725 3.635 . 0 0 "[ . 1 . 2]" 1
581 1 62 VAL QG 1 81 ASP H . . 3.630 3.031 2.429 3.633 0.003 1 0 "[ . 1 . 2]" 1
582 1 62 VAL QG 1 81 ASP QB . . 3.900 2.816 2.166 3.961 0.061 5 0 "[ . 1 . 2]" 1
583 1 62 VAL QG 1 83 LEU H . . 4.030 3.796 3.364 4.112 0.082 11 0 "[ . 1 . 2]" 1
584 1 63 LYS H 1 63 LYS HB2 . . 3.830 2.756 2.588 2.950 . 0 0 "[ . 1 . 2]" 1
585 1 63 LYS H 1 63 LYS HB3 . . 3.990 2.451 2.338 2.520 . 0 0 "[ . 1 . 2]" 1
586 1 63 LYS H 1 63 LYS QD . . 4.630 4.385 4.214 4.643 0.013 13 0 "[ . 1 . 2]" 1
587 1 63 LYS H 1 64 ASN H . . 3.790 2.437 2.185 2.723 . 0 0 "[ . 1 . 2]" 1
588 1 63 LYS HA 1 63 LYS QD . . 4.420 3.372 2.024 4.223 . 0 0 "[ . 1 . 2]" 1
589 1 63 LYS HA 1 63 LYS QE . . 5.340 4.001 2.726 4.576 . 0 0 "[ . 1 . 2]" 1
590 1 63 LYS HB2 1 63 LYS QD . . 2.690 2.419 2.083 2.806 0.116 5 0 "[ . 1 . 2]" 1
591 1 63 LYS HB2 1 63 LYS QE . . 3.180 2.808 1.967 3.455 0.275 9 0 "[ . 1 . 2]" 1
592 1 63 LYS HB2 1 64 ASN H . . 3.670 3.687 3.570 3.768 0.098 14 0 "[ . 1 . 2]" 1
593 1 63 LYS HB3 1 63 LYS QD . . 3.240 2.694 2.244 3.385 0.145 10 0 "[ . 1 . 2]" 1
594 1 63 LYS HB3 1 63 LYS QE . . 4.260 3.524 1.975 4.021 . 0 0 "[ . 1 . 2]" 1
595 1 63 LYS HB3 1 64 ASN H . . 3.720 2.258 2.073 2.403 . 0 0 "[ . 1 . 2]" 1
596 1 63 LYS QD 1 64 ASN H . . 4.600 4.202 3.802 4.640 0.040 13 0 "[ . 1 . 2]" 1
597 1 64 ASN H 1 64 ASN HB2 . . 4.040 3.133 2.714 3.312 . 0 0 "[ . 1 . 2]" 1
598 1 64 ASN H 1 65 ILE H . . 4.800 4.304 4.238 4.389 . 0 0 "[ . 1 . 2]" 1
599 1 64 ASN HA 1 65 ILE H . . 3.420 2.220 2.098 2.357 . 0 0 "[ . 1 . 2]" 1
600 1 64 ASN HA 1 79 ALA MB . . 3.920 2.632 2.331 2.848 . 0 0 "[ . 1 . 2]" 1
601 1 64 ASN HB2 1 65 ILE H . . 4.560 3.996 3.751 4.186 . 0 0 "[ . 1 . 2]" 1
602 1 64 ASN HB2 1 79 ALA MB . . 4.710 4.672 4.343 4.794 0.084 11 0 "[ . 1 . 2]" 1
603 1 64 ASN HB3 1 65 ILE H . . 3.670 3.537 2.502 3.732 0.062 16 0 "[ . 1 . 2]" 1
604 1 64 ASN HB3 1 66 LEU H . . 4.460 4.537 4.490 4.561 0.101 5 0 "[ . 1 . 2]" 1
605 1 64 ASN HB3 1 79 ALA MB . . 4.860 4.840 4.419 4.965 0.105 11 0 "[ . 1 . 2]" 1
606 1 65 ILE H 1 65 ILE HB . . 3.690 2.465 2.397 2.530 . 0 0 "[ . 1 . 2]" 1
607 1 65 ILE H 1 65 ILE MD . . 4.580 3.876 3.688 3.962 . 0 0 "[ . 1 . 2]" 1
608 1 65 ILE H 1 65 ILE QG . . 3.480 2.865 2.720 3.024 . 0 0 "[ . 1 . 2]" 1
609 1 65 ILE H 1 66 LEU H . . 5.300 3.979 3.859 4.101 . 0 0 "[ . 1 . 2]" 1
610 1 65 ILE HA 1 65 ILE MD . . 3.690 2.079 2.016 2.164 . 0 0 "[ . 1 . 2]" 1
611 1 65 ILE HA 1 65 ILE MG . . 3.310 2.536 2.488 2.586 . 0 0 "[ . 1 . 2]" 1
612 1 65 ILE HA 1 66 LEU H . . 3.480 2.093 2.018 2.145 . 0 0 "[ . 1 . 2]" 1
613 1 65 ILE HA 1 71 ALA MB . . 4.800 3.535 3.274 4.001 . 0 0 "[ . 1 . 2]" 1
614 1 65 ILE HB 1 66 LEU H . . 4.780 4.391 4.343 4.434 . 0 0 "[ . 1 . 2]" 1
615 1 65 ILE HB 1 71 ALA MB . . 5.120 4.496 4.319 5.041 . 0 0 "[ . 1 . 2]" 1
616 1 65 ILE HB 1 78 LYS HA . . 4.540 4.074 3.856 4.322 . 0 0 "[ . 1 . 2]" 1
617 1 65 ILE HB 1 79 ALA H . . 4.620 3.830 3.451 4.050 . 0 0 "[ . 1 . 2]" 1
618 1 65 ILE MD 1 65 ILE MG . . 3.200 1.978 1.900 2.016 . 0 0 "[ . 1 . 2]" 1
619 1 65 ILE MD 1 66 LEU H . . 4.570 3.751 3.557 3.927 . 0 0 "[ . 1 . 2]" 1
620 1 65 ILE MD 1 71 ALA MB . . 3.580 2.109 1.926 2.559 . 0 0 "[ . 1 . 2]" 1
621 1 65 ILE MD 1 77 LEU H . . 5.310 4.793 4.394 5.087 . 0 0 "[ . 1 . 2]" 1
622 1 65 ILE MD 1 77 LEU HA . . 4.510 4.519 4.379 4.563 0.053 10 0 "[ . 1 . 2]" 1
623 1 65 ILE MD 1 77 LEU HB2 . . 4.590 4.452 4.194 4.664 0.074 5 0 "[ . 1 . 2]" 1
624 1 65 ILE MD 1 77 LEU HB3 . . 5.160 3.276 2.960 3.608 . 0 0 "[ . 1 . 2]" 1
625 1 65 ILE MD 1 77 LEU QD . . 3.460 2.621 1.896 2.856 . 0 0 "[ . 1 . 2]" 1
626 1 65 ILE MD 1 77 LEU HG . . 4.650 2.334 2.037 4.239 . 0 0 "[ . 1 . 2]" 1
627 1 65 ILE MD 1 78 LYS H . . 4.710 3.670 3.412 4.049 . 0 0 "[ . 1 . 2]" 1
628 1 65 ILE MD 1 78 LYS HA . . 4.010 2.682 2.324 2.969 . 0 0 "[ . 1 . 2]" 1
629 1 65 ILE MD 1 78 LYS QB . . 4.730 4.118 3.801 4.360 . 0 0 "[ . 1 . 2]" 1
630 1 65 ILE MD 1 79 ALA H . . 4.250 3.594 3.077 3.987 . 0 0 "[ . 1 . 2]" 1
631 1 65 ILE MD 1 79 ALA MB . . 4.620 3.248 2.723 3.443 . 0 0 "[ . 1 . 2]" 1
632 1 65 ILE QG 1 78 LYS HA . . 4.440 1.881 1.807 1.928 . 0 0 "[ . 1 . 2]" 1
633 1 65 ILE QG 1 79 ALA MB . . 3.190 1.833 1.764 1.944 . 0 0 "[ . 1 . 2]" 1
634 1 65 ILE MG 1 66 LEU H . . 3.850 3.274 3.061 3.384 . 0 0 "[ . 1 . 2]" 1
635 1 65 ILE MG 1 71 ALA MB . . 3.400 1.991 1.843 2.567 . 0 0 "[ . 1 . 2]" 1
636 1 65 ILE MG 1 72 ILE H . . 4.790 3.794 3.270 4.571 . 0 0 "[ . 1 . 2]" 1
637 1 65 ILE MG 1 77 LEU QD . . 5.080 4.206 3.888 4.674 . 0 0 "[ . 1 . 2]" 1
638 1 65 ILE MG 1 78 LYS HA . . 4.710 3.069 2.829 3.433 . 0 0 "[ . 1 . 2]" 1
639 1 65 ILE MG 1 78 LYS QB . . 3.930 3.987 3.664 4.111 0.181 3 0 "[ . 1 . 2]" 1
640 1 65 ILE MG 1 79 ALA H . . 5.280 4.142 3.834 4.353 . 0 0 "[ . 1 . 2]" 1
641 1 65 ILE MG 1 79 ALA MB . . 4.020 4.139 4.030 4.214 0.194 5 0 "[ . 1 . 2]" 1
642 1 66 LEU H 1 66 LEU HB2 . . 3.550 2.457 2.273 2.550 . 0 0 "[ . 1 . 2]" 1
643 1 66 LEU H 1 66 LEU HB3 . . 4.080 3.621 3.550 3.673 . 0 0 "[ . 1 . 2]" 1
644 1 66 LEU H 1 68 ARG H . . 5.430 4.975 4.675 5.127 . 0 0 "[ . 1 . 2]" 1
645 1 66 LEU HA 1 66 LEU QD . . 3.460 2.373 1.986 2.797 . 0 0 "[ . 1 . 2]" 1
646 1 66 LEU HA 1 67 PRO QD . . 3.380 2.045 1.917 2.362 . 0 0 "[ . 1 . 2]" 1
647 1 66 LEU HB2 1 67 PRO QD . . 4.410 3.793 3.449 4.145 . 0 0 "[ . 1 . 2]" 1
648 1 66 LEU HB2 1 68 ARG H . . 5.040 3.580 3.045 3.858 . 0 0 "[ . 1 . 2]" 1
649 1 66 LEU HB3 1 67 PRO QD . . 4.060 2.460 1.908 3.072 . 0 0 "[ . 1 . 2]" 1
650 1 66 LEU HB3 1 68 ARG H . . 4.110 2.986 2.481 3.384 . 0 0 "[ . 1 . 2]" 1
651 1 66 LEU QD 1 67 PRO QD . . 4.360 2.946 2.262 3.666 . 0 0 "[ . 1 . 2]" 1
652 1 67 PRO HA 1 72 ILE MD . . 3.300 2.826 2.365 3.413 0.113 18 0 "[ . 1 . 2]" 1
653 1 67 PRO HB2 1 72 ILE MD . . 4.980 3.806 3.181 4.289 . 0 0 "[ . 1 . 2]" 1
654 1 67 PRO HB3 1 68 ARG QG . . 4.710 4.739 4.256 4.902 0.192 14 0 "[ . 1 . 2]" 1
655 1 67 PRO QD 1 68 ARG H . . 4.470 3.288 2.744 3.636 . 0 0 "[ . 1 . 2]" 1
656 1 67 PRO QG 1 68 ARG H . . 4.550 3.184 2.280 3.591 . 0 0 "[ . 1 . 2]" 1
657 1 67 PRO QG 1 69 GLY H . . 4.840 4.940 4.725 5.159 0.319 7 0 "[ . 1 . 2]" 1
658 1 68 ARG H 1 68 ARG HB2 . . 3.950 3.658 2.662 3.953 0.003 20 0 "[ . 1 . 2]" 1
659 1 68 ARG H 1 68 ARG QD . . 5.180 4.529 4.349 4.797 . 0 0 "[ . 1 . 2]" 1
660 1 68 ARG H 1 68 ARG QG . . 3.870 2.697 2.369 3.616 . 0 0 "[ . 1 . 2]" 1
661 1 68 ARG H 1 69 GLY H . . 4.450 2.219 1.577 4.050 . 0 0 "[ . 1 . 2]" 1
662 1 68 ARG H 1 72 ILE HB . . 4.210 4.142 3.490 4.305 0.095 7 0 "[ . 1 . 2]" 1
663 1 68 ARG H 1 72 ILE MD . . 4.490 3.904 3.611 4.323 . 0 0 "[ . 1 . 2]" 1
664 1 68 ARG H 1 72 ILE MG . . 4.710 2.836 2.107 3.974 . 0 0 "[ . 1 . 2]" 1
665 1 68 ARG HA 1 68 ARG QG . . 3.530 3.099 2.349 3.299 . 0 0 "[ . 1 . 2]" 1
666 1 68 ARG HA 1 69 GLY H . . 3.230 2.996 1.755 3.311 0.081 1 0 "[ . 1 . 2]" 1
667 1 68 ARG HA 1 72 ILE MD . . 3.670 2.815 2.635 3.224 . 0 0 "[ . 1 . 2]" 1
668 1 68 ARG HA 1 72 ILE MG . . 3.880 2.032 1.708 2.626 . 0 0 "[ . 1 . 2]" 1
669 1 68 ARG HB2 1 69 GLY H . . 4.000 3.802 1.701 4.115 0.115 17 0 "[ . 1 . 2]" 1
670 1 68 ARG HB2 1 72 ILE MD . . 4.690 4.841 4.724 4.907 0.217 7 0 "[ . 1 . 2]" 1
671 1 68 ARG QD 1 69 GLY H . . 5.040 4.753 3.320 5.139 0.099 17 0 "[ . 1 . 2]" 1
672 1 68 ARG QG 1 69 GLY H . . 4.360 3.144 2.394 3.746 . 0 0 "[ . 1 . 2]" 1
673 1 68 ARG QG 1 72 ILE MG . . 4.000 3.880 3.134 4.144 0.144 20 0 "[ . 1 . 2]" 1
674 1 69 GLY H 1 70 ALA H . . 4.560 4.432 4.267 4.608 0.048 18 0 "[ . 1 . 2]" 1
675 1 69 GLY H 1 72 ILE MG . . 3.910 2.465 1.844 3.248 . 0 0 "[ . 1 . 2]" 1
676 1 69 GLY HA2 1 71 ALA H . . 4.900 4.621 4.351 4.860 . 0 0 "[ . 1 . 2]" 1
677 1 69 GLY HA3 1 70 ALA H . . 3.540 2.349 2.219 2.519 . 0 0 "[ . 1 . 2]" 1
678 1 69 GLY HA3 1 72 ILE H . . 4.890 4.375 4.112 4.672 . 0 0 "[ . 1 . 2]" 1
679 1 69 GLY HA3 1 72 ILE MG . . 4.170 3.792 3.445 4.187 0.017 20 0 "[ . 1 . 2]" 1
680 1 70 ALA H 1 70 ALA MB . . 3.110 2.195 2.116 2.315 . 0 0 "[ . 1 . 2]" 1
681 1 70 ALA H 1 71 ALA H . . 3.710 2.610 2.427 2.876 . 0 0 "[ . 1 . 2]" 1
682 1 70 ALA HA 1 73 GLN H . . 4.390 3.511 3.085 3.892 . 0 0 "[ . 1 . 2]" 1
683 1 70 ALA HA 1 73 GLN HB2 . . 3.820 2.666 2.072 3.052 . 0 0 "[ . 1 . 2]" 1
684 1 70 ALA HA 1 74 ASP H . . 4.240 4.037 3.606 4.311 0.071 14 0 "[ . 1 . 2]" 1
685 1 70 ALA MB 1 71 ALA H . . 3.490 2.542 2.328 2.868 . 0 0 "[ . 1 . 2]" 1
686 1 70 ALA MB 1 112 VAL QG . . 5.130 4.348 3.615 4.763 . 0 0 "[ . 1 . 2]" 1
687 1 71 ALA H 1 71 ALA MB . . 3.190 2.223 2.189 2.276 . 0 0 "[ . 1 . 2]" 1
688 1 71 ALA H 1 72 ILE H . . 4.060 2.780 2.668 2.828 . 0 0 "[ . 1 . 2]" 1
689 1 71 ALA H 1 73 GLN H . . 4.880 4.047 3.799 4.290 . 0 0 "[ . 1 . 2]" 1
690 1 71 ALA H 1 77 LEU QD . . 5.190 4.800 4.128 5.248 0.058 13 0 "[ . 1 . 2]" 1
691 1 71 ALA HA 1 74 ASP H . . 4.500 3.987 3.781 4.181 . 0 0 "[ . 1 . 2]" 1
692 1 71 ALA HA 1 74 ASP QB . . 4.720 3.783 3.410 4.398 . 0 0 "[ . 1 . 2]" 1
693 1 71 ALA HA 1 75 GLY H . . 4.310 3.683 3.451 4.063 . 0 0 "[ . 1 . 2]" 1
694 1 71 ALA MB 1 72 ILE H . . 3.660 2.570 2.337 2.738 . 0 0 "[ . 1 . 2]" 1
695 1 71 ALA MB 1 73 GLN H . . 5.070 4.478 4.275 4.665 . 0 0 "[ . 1 . 2]" 1
696 1 71 ALA MB 1 77 LEU HB2 . . 4.150 4.136 3.753 4.237 0.087 20 0 "[ . 1 . 2]" 1
697 1 71 ALA MB 1 77 LEU HB3 . . 4.010 2.711 2.271 2.934 . 0 0 "[ . 1 . 2]" 1
698 1 71 ALA MB 1 77 LEU QD . . 3.750 2.718 2.269 3.149 . 0 0 "[ . 1 . 2]" 1
699 1 72 ILE H 1 72 ILE HB . . 3.540 2.673 2.439 2.780 . 0 0 "[ . 1 . 2]" 1
700 1 72 ILE H 1 72 ILE HG12 . . 4.600 4.452 4.362 4.510 . 0 0 "[ . 1 . 2]" 1
701 1 72 ILE H 1 72 ILE QG . . 4.040 4.003 3.953 4.068 0.028 9 0 "[ . 1 . 2]" 1
702 1 72 ILE H 1 72 ILE HG13 . . 4.600 4.539 4.403 4.635 0.035 10 0 "[ . 1 . 2]" 1
703 1 72 ILE H 1 72 ILE MG . . 3.260 1.928 1.718 2.140 . 0 0 "[ . 1 . 2]" 1
704 1 72 ILE H 1 73 GLN H . . 3.690 2.462 2.376 2.576 . 0 0 "[ . 1 . 2]" 1
705 1 72 ILE H 1 74 ASP H . . 4.860 4.207 4.012 4.361 . 0 0 "[ . 1 . 2]" 1
706 1 72 ILE HA 1 72 ILE MD . . 3.630 3.734 3.472 3.815 0.185 1 0 "[ . 1 . 2]" 1
707 1 72 ILE HA 1 72 ILE HG12 . . 3.880 3.015 2.557 3.121 . 0 0 "[ . 1 . 2]" 1
708 1 72 ILE HA 1 72 ILE QG . . 3.390 2.405 2.314 2.542 . 0 0 "[ . 1 . 2]" 1
709 1 72 ILE HA 1 72 ILE HG13 . . 3.880 2.613 2.399 3.673 . 0 0 "[ . 1 . 2]" 1
710 1 72 ILE HA 1 72 ILE MG . . 3.690 3.187 3.159 3.203 . 0 0 "[ . 1 . 2]" 1
711 1 72 ILE HA 1 74 ASP H . . 4.310 4.355 4.228 4.396 0.086 2 0 "[ . 1 . 2]" 1
712 1 72 ILE HA 1 75 GLY H . . 3.320 3.160 3.059 3.284 . 0 0 "[ . 1 . 2]" 1
713 1 72 ILE HB 1 72 ILE MD . . 3.660 2.488 2.356 3.220 . 0 0 "[ . 1 . 2]" 1
714 1 72 ILE HB 1 75 GLY H . . 5.220 5.338 5.271 5.404 0.184 18 0 "[ . 1 . 2]" 1
715 1 72 ILE MD 1 72 ILE MG . . 2.600 1.792 1.714 1.928 . 0 0 "[ . 1 . 2]" 1
716 1 72 ILE MD 1 73 GLN H . . 4.940 4.540 3.313 4.838 . 0 0 "[ . 1 . 2]" 1
717 1 72 ILE QG 1 72 ILE MG . . 3.230 2.352 2.297 2.449 . 0 0 "[ . 1 . 2]" 1
718 1 72 ILE QG 1 73 GLN H . . 4.810 3.880 3.610 4.355 . 0 0 "[ . 1 . 2]" 1
719 1 72 ILE QG 1 75 GLY H . . 5.020 4.772 4.579 5.044 0.024 10 0 "[ . 1 . 2]" 1
720 1 72 ILE HG12 1 72 ILE MG . . 3.730 2.486 2.360 3.156 . 0 0 "[ . 1 . 2]" 1
721 1 72 ILE HG13 1 72 ILE MG . . 3.730 3.118 2.502 3.204 . 0 0 "[ . 1 . 2]" 1
722 1 72 ILE MG 1 73 GLN H . . 3.470 2.273 2.069 2.441 . 0 0 "[ . 1 . 2]" 1
723 1 72 ILE MG 1 73 GLN HB2 . . 4.610 3.965 3.250 4.446 . 0 0 "[ . 1 . 2]" 1
724 1 72 ILE MG 1 74 ASP H . . 5.220 4.469 4.310 4.603 . 0 0 "[ . 1 . 2]" 1
725 1 72 ILE MG 1 75 GLY H . . 4.920 4.822 4.684 4.987 0.067 6 0 "[ . 1 . 2]" 1
726 1 73 GLN H 1 73 GLN HB2 . . 3.380 2.433 1.957 2.664 . 0 0 "[ . 1 . 2]" 1
727 1 73 GLN H 1 73 GLN HG2 . . 4.120 2.617 2.106 4.115 . 0 0 "[ . 1 . 2]" 1
728 1 73 GLN H 1 73 GLN QG . . 3.550 2.525 2.093 3.693 0.143 3 0 "[ . 1 . 2]" 1
729 1 73 GLN H 1 73 GLN HG3 . . 4.120 3.788 3.635 4.214 0.094 1 0 "[ . 1 . 2]" 1
730 1 73 GLN H 1 74 ASP H . . 3.820 2.670 2.566 2.789 . 0 0 "[ . 1 . 2]" 1
731 1 73 GLN H 1 75 GLY H . . 4.500 3.741 3.543 4.039 . 0 0 "[ . 1 . 2]" 1
732 1 73 GLN HA 1 73 GLN QG . . 3.540 2.876 2.440 3.091 . 0 0 "[ . 1 . 2]" 1
733 1 73 GLN HB2 1 74 ASP H . . 3.980 2.722 2.359 3.590 . 0 0 "[ . 1 . 2]" 1
734 1 73 GLN HB2 1 75 GLY H . . 5.240 4.816 4.551 5.259 0.019 3 0 "[ . 1 . 2]" 1
735 1 74 ASP H 1 74 ASP HB2 . . 3.890 2.513 2.386 2.910 . 0 0 "[ . 1 . 2]" 1
736 1 74 ASP H 1 74 ASP HB3 . . 3.890 3.416 2.431 3.729 . 0 0 "[ . 1 . 2]" 1
737 1 74 ASP H 1 75 GLY H . . 3.620 2.283 2.087 2.556 . 0 0 "[ . 1 . 2]" 1
738 1 74 ASP QB 1 75 GLY H . . 3.670 2.760 2.496 3.042 . 0 0 "[ . 1 . 2]" 1
739 1 74 ASP QB 1 76 ARG QD . . 4.430 4.039 2.413 4.573 0.143 4 0 "[ . 1 . 2]" 1
740 1 74 ASP HB2 1 75 GLY H . . 4.180 3.140 2.671 3.957 . 0 0 "[ . 1 . 2]" 1
741 1 74 ASP HB2 1 76 ARG H . . 4.470 3.562 2.725 4.507 0.037 18 0 "[ . 1 . 2]" 1
742 1 74 ASP HB3 1 75 GLY H . . 4.180 3.494 2.524 3.983 . 0 0 "[ . 1 . 2]" 1
743 1 74 ASP HB3 1 76 ARG H . . 4.470 3.300 2.500 4.410 . 0 0 "[ . 1 . 2]" 1
744 1 76 ARG H 1 76 ARG HB3 . . 3.800 3.108 2.356 3.816 0.016 9 0 "[ . 1 . 2]" 1
745 1 76 ARG H 1 76 ARG QD . . 4.630 4.029 3.455 4.395 . 0 0 "[ . 1 . 2]" 1
746 1 76 ARG H 1 77 LEU H . . 3.800 2.349 1.971 3.058 . 0 0 "[ . 1 . 2]" 1
747 1 76 ARG HB3 1 77 LEU H . . 4.110 3.560 3.042 4.133 0.023 7 0 "[ . 1 . 2]" 1
748 1 76 ARG QG 1 77 LEU H . . 4.310 4.190 3.800 4.352 0.042 18 0 "[ . 1 . 2]" 1
749 1 77 LEU H 1 77 LEU HB2 . . 3.700 2.846 2.655 3.082 . 0 0 "[ . 1 . 2]" 1
750 1 77 LEU H 1 77 LEU MD1 . . 4.740 4.282 4.188 4.501 . 0 0 "[ . 1 . 2]" 1
751 1 77 LEU H 1 77 LEU QD . . 4.120 3.837 3.759 3.940 . 0 0 "[ . 1 . 2]" 1
752 1 77 LEU H 1 77 LEU MD2 . . 4.740 4.339 4.117 4.499 . 0 0 "[ . 1 . 2]" 1
753 1 77 LEU H 1 78 LYS H . . 4.870 4.478 4.243 4.558 . 0 0 "[ . 1 . 2]" 1
754 1 77 LEU HA 1 77 LEU QD . . 3.490 2.144 2.047 3.005 . 0 0 "[ . 1 . 2]" 1
755 1 77 LEU HA 1 78 LYS H . . 3.290 2.250 2.140 2.349 . 0 0 "[ . 1 . 2]" 1
756 1 77 LEU HB3 1 114 LEU HG . . 5.220 4.932 4.408 5.293 0.073 13 0 "[ . 1 . 2]" 1
757 1 77 LEU QD 1 78 LYS H . . 3.700 2.255 1.859 3.049 . 0 0 "[ . 1 . 2]" 1
758 1 77 LEU QD 1 83 LEU QD . . 3.710 2.777 2.026 3.130 . 0 0 "[ . 1 . 2]" 1
759 1 77 LEU QD 1 114 LEU HB2 . . 3.930 3.167 2.530 3.583 . 0 0 "[ . 1 . 2]" 1
760 1 77 LEU HG 1 78 LYS H . . 5.310 2.858 2.359 3.891 . 0 0 "[ . 1 . 2]" 1
761 1 78 LYS H 1 78 LYS QB . . 3.490 3.198 2.871 3.311 . 0 0 "[ . 1 . 2]" 1
762 1 78 LYS H 1 78 LYS QD . . 3.490 2.252 1.851 3.689 0.199 6 0 "[ . 1 . 2]" 1
763 1 78 LYS H 1 81 ASP QB . . 5.130 4.323 3.462 5.258 0.128 5 0 "[ . 1 . 2]" 1
764 1 78 LYS HA 1 78 LYS QE . . 4.540 3.948 3.625 4.404 . 0 0 "[ . 1 . 2]" 1
765 1 78 LYS HA 1 79 ALA H . . 3.210 2.529 2.210 2.691 . 0 0 "[ . 1 . 2]" 1
766 1 78 LYS QB 1 78 LYS QE . . 2.850 2.064 1.950 2.203 . 0 0 "[ . 1 . 2]" 1
767 1 78 LYS QB 1 79 ALA H . . 3.300 2.240 2.042 2.598 . 0 0 "[ . 1 . 2]" 1
768 1 78 LYS HB2 1 79 ALA H . . 3.760 2.264 2.057 2.673 . 0 0 "[ . 1 . 2]" 1
769 1 78 LYS HB3 1 79 ALA H . . 3.760 3.605 3.367 3.794 0.034 2 0 "[ . 1 . 2]" 1
770 1 79 ALA H 1 79 ALA MB . . 3.040 2.289 2.228 2.411 . 0 0 "[ . 1 . 2]" 1
771 1 79 ALA H 1 80 GLY H . . 4.510 4.352 2.952 4.562 0.052 16 0 "[ . 1 . 2]" 1
772 1 79 ALA HA 1 81 ASP H . . 3.920 3.351 3.056 3.736 . 0 0 "[ . 1 . 2]" 1
773 1 79 ALA MB 1 80 GLY H . . 3.830 2.840 2.243 3.620 . 0 0 "[ . 1 . 2]" 1
774 1 79 ALA MB 1 81 ASP H . . 4.490 4.420 4.061 4.597 0.107 2 0 "[ . 1 . 2]" 1
775 1 80 GLY H 1 81 ASP H . . 3.800 2.252 1.596 2.797 . 0 0 "[ . 1 . 2]" 1
776 1 81 ASP H 1 81 ASP QB . . 3.390 2.574 2.331 3.321 . 0 0 "[ . 1 . 2]" 1
777 1 81 ASP H 1 82 ARG H . . 4.800 4.478 4.311 4.614 . 0 0 "[ . 1 . 2]" 1
778 1 81 ASP HA 1 116 VAL HB . . 5.230 4.820 3.553 5.246 0.016 7 0 "[ . 1 . 2]" 1
779 1 81 ASP HA 1 117 PHE H . . 5.370 5.155 4.436 5.449 0.079 3 0 "[ . 1 . 2]" 1
780 1 81 ASP QB 1 116 VAL HB . . 3.960 2.637 1.934 3.893 . 0 0 "[ . 1 . 2]" 1
781 1 81 ASP QB 1 116 VAL MG1 . . 4.300 3.088 1.925 3.950 . 0 0 "[ . 1 . 2]" 1
782 1 81 ASP QB 1 116 VAL MG2 . . 4.240 3.366 2.744 4.254 0.014 7 0 "[ . 1 . 2]" 1
783 1 81 ASP HB2 1 82 ARG H . . 5.500 3.581 2.009 4.241 . 0 0 "[ . 1 . 2]" 1
784 1 81 ASP HB3 1 82 ARG H . . 5.500 2.748 2.071 3.745 . 0 0 "[ . 1 . 2]" 1
785 1 82 ARG H 1 82 ARG HB2 . . 4.100 2.889 2.576 3.205 . 0 0 "[ . 1 . 2]" 1
786 1 82 ARG H 1 116 VAL HA . . 5.280 4.643 3.998 5.176 . 0 0 "[ . 1 . 2]" 1
787 1 82 ARG H 1 116 VAL HB . . 4.890 3.570 2.572 4.064 . 0 0 "[ . 1 . 2]" 1
788 1 82 ARG H 1 116 VAL MG1 . . 4.880 4.492 3.607 4.890 0.010 10 0 "[ . 1 . 2]" 1
789 1 82 ARG H 1 117 PHE H . . 4.210 3.024 2.723 3.312 . 0 0 "[ . 1 . 2]" 1
790 1 82 ARG H 1 117 PHE QB . . 5.140 3.720 2.903 4.688 . 0 0 "[ . 1 . 2]" 1
791 1 82 ARG HA 1 83 LEU H . . 3.490 2.139 2.027 2.231 . 0 0 "[ . 1 . 2]" 1
792 1 82 ARG HB2 1 117 PHE QD . . 5.220 3.692 2.749 4.724 . 0 0 "[ . 1 . 2]" 1
793 1 82 ARG HB3 1 83 LEU H . . 4.600 4.120 4.003 4.276 . 0 0 "[ . 1 . 2]" 1
794 1 82 ARG HB3 1 117 PHE H . . 4.450 3.050 2.505 3.553 . 0 0 "[ . 1 . 2]" 1
795 1 82 ARG HB3 1 117 PHE QD . . 4.270 2.899 2.102 3.920 . 0 0 "[ . 1 . 2]" 1
796 1 82 ARG QD 1 83 LEU H . . 4.770 4.307 2.565 4.738 . 0 0 "[ . 1 . 2]" 1
797 1 82 ARG QD 1 84 ILE MD . . 4.340 2.525 1.833 3.924 . 0 0 "[ . 1 . 2]" 1
798 1 82 ARG QD 1 91 LEU QD . . 5.280 5.318 4.341 5.552 0.272 9 0 "[ . 1 . 2]" 1
799 1 82 ARG QD 1 117 PHE QD . . 4.150 3.286 2.468 4.229 0.079 17 0 "[ . 1 . 2]" 1
800 1 82 ARG HD2 1 84 ILE MD . . 4.980 2.849 1.866 4.105 . 0 0 "[ . 1 . 2]" 1
801 1 82 ARG HD3 1 84 ILE MD . . 4.980 3.148 2.031 4.986 0.006 6 0 "[ . 1 . 2]" 1
802 1 82 ARG QG 1 83 LEU H . . 3.380 2.547 2.284 2.774 . 0 0 "[ . 1 . 2]" 1
803 1 82 ARG HG2 1 83 LEU H . . 4.020 2.793 2.327 3.370 . 0 0 "[ . 1 . 2]" 1
804 1 82 ARG HG3 1 83 LEU H . . 4.020 3.114 2.427 4.172 0.152 11 0 "[ . 1 . 2]" 1
805 1 83 LEU H 1 83 LEU HB2 . . 4.160 2.323 2.098 2.589 . 0 0 "[ . 1 . 2]" 1
806 1 83 LEU H 1 83 LEU MD1 . . 4.260 4.067 3.929 4.270 0.010 15 0 "[ . 1 . 2]" 1
807 1 83 LEU H 1 83 LEU QD . . 3.390 3.121 2.437 3.648 0.258 10 0 "[ . 1 . 2]" 1
808 1 83 LEU H 1 83 LEU MD2 . . 4.260 3.341 2.460 4.187 . 0 0 "[ . 1 . 2]" 1
809 1 83 LEU H 1 84 ILE H . . 4.820 4.416 4.274 4.520 . 0 0 "[ . 1 . 2]" 1
810 1 83 LEU H 1 91 LEU QD . . 5.050 4.057 3.774 4.354 . 0 0 "[ . 1 . 2]" 1
811 1 83 LEU HA 1 83 LEU QD . . 3.560 1.937 1.860 1.982 . 0 0 "[ . 1 . 2]" 1
812 1 83 LEU HA 1 83 LEU HG . . 4.130 3.478 2.990 3.741 . 0 0 "[ . 1 . 2]" 1
813 1 83 LEU HA 1 85 GLU H . . 4.290 4.046 3.635 4.269 . 0 0 "[ . 1 . 2]" 1
814 1 83 LEU HA 1 116 VAL HA . . 4.840 2.681 2.421 3.110 . 0 0 "[ . 1 . 2]" 1
815 1 83 LEU HA 1 116 VAL MG1 . . 4.060 2.640 2.315 3.133 . 0 0 "[ . 1 . 2]" 1
816 1 83 LEU HA 1 117 PHE H . . 4.830 3.918 3.543 4.505 . 0 0 "[ . 1 . 2]" 1
817 1 83 LEU HB2 1 83 LEU HG . . 2.950 2.569 2.369 2.999 0.049 1 0 "[ . 1 . 2]" 1
818 1 83 LEU HB2 1 84 ILE H . . 4.930 4.385 4.062 4.533 . 0 0 "[ . 1 . 2]" 1
819 1 83 LEU HB3 1 84 ILE H . . 4.180 3.673 2.980 4.188 0.008 3 0 "[ . 1 . 2]" 1
820 1 83 LEU HB3 1 91 LEU QB . . 4.890 4.153 3.586 4.771 . 0 0 "[ . 1 . 2]" 1
821 1 83 LEU HB3 1 91 LEU MD1 . . 5.110 2.005 1.682 2.699 . 0 0 "[ . 1 . 2]" 1
822 1 83 LEU HB3 1 91 LEU QD . . 3.690 2.001 1.681 2.687 . 0 0 "[ . 1 . 2]" 1
823 1 83 LEU HB3 1 91 LEU MD2 . . 5.110 4.219 3.712 4.986 . 0 0 "[ . 1 . 2]" 1
824 1 83 LEU QD 1 84 ILE H . . 4.530 2.785 2.143 3.302 . 0 0 "[ . 1 . 2]" 1
825 1 83 LEU QD 1 91 LEU QD . . 2.390 2.231 1.792 2.532 0.142 2 0 "[ . 1 . 2]" 1
826 1 83 LEU QD 1 117 PHE H . . 5.080 4.554 4.235 5.128 0.048 3 0 "[ . 1 . 2]" 1
827 1 84 ILE H 1 84 ILE HB . . 4.160 2.535 2.406 2.676 . 0 0 "[ . 1 . 2]" 1
828 1 84 ILE H 1 84 ILE MD . . 4.510 3.510 2.257 4.048 . 0 0 "[ . 1 . 2]" 1
829 1 84 ILE H 1 84 ILE HG12 . . 4.560 2.857 2.490 4.293 . 0 0 "[ . 1 . 2]" 1
830 1 84 ILE H 1 84 ILE QG . . 4.000 2.712 2.462 3.686 . 0 0 "[ . 1 . 2]" 1
831 1 84 ILE H 1 84 ILE HG13 . . 4.560 3.912 2.692 4.084 . 0 0 "[ . 1 . 2]" 1
832 1 84 ILE H 1 84 ILE MG . . 4.410 3.825 3.770 3.889 . 0 0 "[ . 1 . 2]" 1
833 1 84 ILE H 1 85 GLU H . . 3.650 2.222 1.961 2.364 . 0 0 "[ . 1 . 2]" 1
834 1 84 ILE H 1 91 LEU QD . . 4.320 3.421 3.140 3.632 . 0 0 "[ . 1 . 2]" 1
835 1 84 ILE H 1 115 LEU H . . 4.920 4.013 3.739 4.398 . 0 0 "[ . 1 . 2]" 1
836 1 84 ILE H 1 116 VAL HA . . 4.320 2.722 2.506 2.876 . 0 0 "[ . 1 . 2]" 1
837 1 84 ILE H 1 116 VAL HB . . 5.080 5.026 4.732 5.154 0.074 7 0 "[ . 1 . 2]" 1
838 1 84 ILE HA 1 84 ILE MD . . 3.910 2.265 2.047 3.855 . 0 0 "[ . 1 . 2]" 1
839 1 84 ILE HA 1 84 ILE QG . . 3.600 2.895 2.473 3.023 . 0 0 "[ . 1 . 2]" 1
840 1 84 ILE HA 1 84 ILE MG . . 3.290 2.430 2.357 2.603 . 0 0 "[ . 1 . 2]" 1
841 1 84 ILE HA 1 91 LEU MD1 . . 5.050 3.164 2.697 3.482 . 0 0 "[ . 1 . 2]" 1
842 1 84 ILE HA 1 91 LEU QD . . 4.240 3.135 2.687 3.429 . 0 0 "[ . 1 . 2]" 1
843 1 84 ILE HA 1 91 LEU MD2 . . 5.050 5.144 5.077 5.275 0.225 20 0 "[ . 1 . 2]" 1
844 1 84 ILE HA 1 91 LEU HG . . 5.270 3.828 3.722 3.977 . 0 0 "[ . 1 . 2]" 1
845 1 84 ILE HA 1 115 LEU QD . . 4.280 4.351 4.254 4.401 0.121 17 0 "[ . 1 . 2]" 1
846 1 84 ILE HB 1 85 GLU H . . 3.610 2.499 2.206 2.798 . 0 0 "[ . 1 . 2]" 1
847 1 84 ILE HB 1 115 LEU QB . . 4.480 2.597 2.161 3.499 . 0 0 "[ . 1 . 2]" 1
848 1 84 ILE HB 1 115 LEU QD . . 4.060 2.007 1.800 2.287 . 0 0 "[ . 1 . 2]" 1
849 1 84 ILE HB 1 116 VAL HA . . 5.200 3.951 3.523 4.243 . 0 0 "[ . 1 . 2]" 1
850 1 84 ILE MD 1 84 ILE MG . . 3.220 2.100 1.840 3.232 0.012 18 0 "[ . 1 . 2]" 1
851 1 84 ILE MD 1 116 VAL HA . . 5.070 4.226 2.127 4.715 . 0 0 "[ . 1 . 2]" 1
852 1 84 ILE MD 1 117 PHE H . . 5.110 3.792 2.359 4.231 . 0 0 "[ . 1 . 2]" 1
853 1 84 ILE MD 1 117 PHE HA . . 5.070 4.192 3.212 4.767 . 0 0 "[ . 1 . 2]" 1
854 1 84 ILE MD 1 117 PHE QB . . 4.480 2.031 1.786 2.319 . 0 0 "[ . 1 . 2]" 1
855 1 84 ILE MD 1 117 PHE QD . . 4.140 3.373 2.691 3.739 . 0 0 "[ . 1 . 2]" 1
856 1 84 ILE QG 1 85 GLU H . . 4.700 4.004 3.837 4.559 . 0 0 "[ . 1 . 2]" 1
857 1 84 ILE QG 1 115 LEU QD . . 4.650 2.910 2.364 3.438 . 0 0 "[ . 1 . 2]" 1
858 1 84 ILE QG 1 116 VAL HA . . 4.270 3.098 2.780 4.255 . 0 0 "[ . 1 . 2]" 1
859 1 84 ILE QG 1 117 PHE H . . 4.440 3.137 2.684 4.422 . 0 0 "[ . 1 . 2]" 1
860 1 84 ILE QG 1 117 PHE QB . . 4.090 2.228 1.786 2.788 . 0 0 "[ . 1 . 2]" 1
861 1 84 ILE HG12 1 116 VAL HA . . 4.940 3.263 2.820 4.644 . 0 0 "[ . 1 . 2]" 1
862 1 84 ILE HG12 1 117 PHE H . . 5.160 3.292 2.740 4.791 . 0 0 "[ . 1 . 2]" 1
863 1 84 ILE HG13 1 116 VAL HA . . 4.940 4.332 3.004 4.991 0.051 3 0 "[ . 1 . 2]" 1
864 1 84 ILE HG13 1 117 PHE H . . 5.160 4.293 3.071 5.192 0.032 18 0 "[ . 1 . 2]" 1
865 1 84 ILE MG 1 85 GLU H . . 4.180 3.320 3.040 3.524 . 0 0 "[ . 1 . 2]" 1
866 1 84 ILE MG 1 85 GLU HA . . 5.150 4.063 3.781 4.198 . 0 0 "[ . 1 . 2]" 1
867 1 84 ILE MG 1 90 ASP HA . . 5.260 4.162 3.725 4.662 . 0 0 "[ . 1 . 2]" 1
868 1 84 ILE MG 1 91 LEU H . . 4.600 4.066 3.669 4.625 0.025 8 0 "[ . 1 . 2]" 1
869 1 84 ILE MG 1 115 LEU HG . . 4.230 3.615 3.108 4.270 0.040 18 0 "[ . 1 . 2]" 1
870 1 85 GLU H 1 85 GLU HB2 . . 4.130 3.845 3.447 3.996 . 0 0 "[ . 1 . 2]" 1
871 1 85 GLU H 1 85 GLU QG . . 4.510 3.000 2.530 4.322 . 0 0 "[ . 1 . 2]" 1
872 1 85 GLU H 1 86 VAL H . . 4.530 4.224 4.108 4.280 . 0 0 "[ . 1 . 2]" 1
873 1 85 GLU H 1 114 LEU HA . . 5.210 4.738 4.458 4.977 . 0 0 "[ . 1 . 2]" 1
874 1 85 GLU H 1 115 LEU H . . 4.180 2.949 2.698 3.216 . 0 0 "[ . 1 . 2]" 1
875 1 85 GLU H 1 115 LEU QB . . 4.370 2.276 2.035 2.732 . 0 0 "[ . 1 . 2]" 1
876 1 85 GLU H 1 115 LEU QD . . 4.190 3.314 3.047 3.530 . 0 0 "[ . 1 . 2]" 1
877 1 85 GLU H 1 116 VAL HA . . 4.740 4.443 4.131 4.738 . 0 0 "[ . 1 . 2]" 1
878 1 85 GLU HA 1 86 VAL H . . 3.330 2.221 2.070 2.330 . 0 0 "[ . 1 . 2]" 1
879 1 85 GLU HA 1 89 VAL H . . 4.770 4.568 3.918 4.804 0.034 11 0 "[ . 1 . 2]" 1
880 1 85 GLU HA 1 90 ASP HA . . 3.620 3.060 2.503 3.388 . 0 0 "[ . 1 . 2]" 1
881 1 85 GLU HA 1 91 LEU H . . 4.420 3.304 2.963 4.049 . 0 0 "[ . 1 . 2]" 1
882 1 85 GLU HA 1 91 LEU QB . . 5.140 4.067 3.854 4.294 . 0 0 "[ . 1 . 2]" 1
883 1 85 GLU HA 1 91 LEU MD1 . . 4.500 3.013 2.587 3.385 . 0 0 "[ . 1 . 2]" 1
884 1 85 GLU HA 1 91 LEU QD . . 3.860 2.422 2.084 2.668 . 0 0 "[ . 1 . 2]" 1
885 1 85 GLU HA 1 91 LEU MD2 . . 4.500 2.577 2.198 3.068 . 0 0 "[ . 1 . 2]" 1
886 1 85 GLU HA 1 91 LEU HG . . 3.900 2.049 1.820 2.258 . 0 0 "[ . 1 . 2]" 1
887 1 85 GLU HB2 1 86 VAL H . . 3.670 3.011 2.515 3.743 0.073 9 0 "[ . 1 . 2]" 1
888 1 85 GLU HB2 1 89 VAL H . . 4.370 3.659 3.215 4.478 0.108 9 0 "[ . 1 . 2]" 1
889 1 85 GLU HB2 1 91 LEU H . . 4.520 4.406 3.884 4.574 0.054 1 0 "[ . 1 . 2]" 1
890 1 85 GLU HB2 1 91 LEU QD . . 4.600 3.976 3.525 4.236 . 0 0 "[ . 1 . 2]" 1
891 1 85 GLU HB3 1 115 LEU QD . . 4.180 3.449 1.978 4.273 0.093 10 0 "[ . 1 . 2]" 1
892 1 85 GLU QG 1 86 VAL H . . 4.120 3.520 2.322 4.175 0.055 6 0 "[ . 1 . 2]" 1
893 1 85 GLU QG 1 88 GLY H . . 4.570 3.567 2.174 4.613 0.043 8 0 "[ . 1 . 2]" 1
894 1 85 GLU QG 1 91 LEU QD . . 4.520 4.309 3.882 4.547 0.027 12 0 "[ . 1 . 2]" 1
895 1 85 GLU QG 1 115 LEU QD . . 4.160 2.553 1.939 4.225 0.065 3 0 "[ . 1 . 2]" 1
896 1 86 VAL H 1 86 VAL MG1 . . 4.290 2.250 2.046 2.537 . 0 0 "[ . 1 . 2]" 1
897 1 86 VAL H 1 86 VAL QG . . 3.580 2.235 2.038 2.507 . 0 0 "[ . 1 . 2]" 1
898 1 86 VAL H 1 86 VAL MG2 . . 4.290 3.842 3.735 3.963 . 0 0 "[ . 1 . 2]" 1
899 1 86 VAL H 1 87 ASN H . . 4.890 4.103 3.961 4.240 . 0 0 "[ . 1 . 2]" 1
900 1 86 VAL H 1 88 GLY H . . 4.900 3.635 3.410 3.840 . 0 0 "[ . 1 . 2]" 1
901 1 86 VAL H 1 89 VAL H . . 3.820 3.059 2.639 3.320 . 0 0 "[ . 1 . 2]" 1
902 1 86 VAL H 1 89 VAL HB . . 4.420 3.668 3.341 4.068 . 0 0 "[ . 1 . 2]" 1
903 1 86 VAL H 1 90 ASP HA . . 4.690 4.378 3.977 4.697 0.007 3 0 "[ . 1 . 2]" 1
904 1 86 VAL H 1 91 LEU MD1 . . 4.160 3.792 3.166 4.203 0.043 17 0 "[ . 1 . 2]" 1
905 1 86 VAL H 1 91 LEU MD2 . . 4.160 2.572 1.879 2.926 . 0 0 "[ . 1 . 2]" 1
906 1 86 VAL H 1 91 LEU HG . . 4.200 3.705 3.295 4.050 . 0 0 "[ . 1 . 2]" 1
907 1 86 VAL H 1 99 VAL QG . . 4.420 4.409 4.229 4.477 0.057 17 0 "[ . 1 . 2]" 1
908 1 86 VAL H 1 102 LEU MD1 . . 4.640 4.607 4.052 4.787 0.147 5 0 "[ . 1 . 2]" 1
909 1 86 VAL H 1 102 LEU QD . . 3.960 3.335 2.945 3.846 . 0 0 "[ . 1 . 2]" 1
910 1 86 VAL H 1 102 LEU MD2 . . 4.640 3.506 2.976 4.663 0.023 8 0 "[ . 1 . 2]" 1
911 1 86 VAL H 1 114 LEU HA . . 4.960 5.068 4.989 5.140 0.180 4 0 "[ . 1 . 2]" 1
912 1 86 VAL HA 1 87 ASN H . . 3.240 2.020 1.895 2.127 . 0 0 "[ . 1 . 2]" 1
913 1 86 VAL HA 1 89 VAL H . . 4.700 4.515 4.260 4.719 0.019 2 0 "[ . 1 . 2]" 1
914 1 86 VAL HA 1 115 LEU H . . 4.950 3.246 2.855 3.586 . 0 0 "[ . 1 . 2]" 1
915 1 86 VAL HB 1 87 ASN H . . 4.500 4.015 3.854 4.215 . 0 0 "[ . 1 . 2]" 1
916 1 86 VAL HB 1 91 LEU QD . . 3.650 3.249 2.911 3.533 . 0 0 "[ . 1 . 2]" 1
917 1 86 VAL HB 1 114 LEU HA . . 4.950 3.313 2.968 3.805 . 0 0 "[ . 1 . 2]" 1
918 1 86 VAL HB 1 114 LEU QD . . 3.350 2.443 2.200 3.107 . 0 0 "[ . 1 . 2]" 1
919 1 86 VAL HB 1 115 LEU H . . 4.320 4.204 3.863 4.366 0.046 1 0 "[ . 1 . 2]" 1
920 1 86 VAL QG 1 88 GLY H . . 4.300 3.944 3.525 4.141 . 0 0 "[ . 1 . 2]" 1
921 1 86 VAL QG 1 113 SER H . . 4.650 3.842 2.986 4.539 . 0 0 "[ . 1 . 2]" 1
922 1 86 VAL QG 1 115 LEU H . . 4.470 4.333 4.065 4.492 0.022 1 0 "[ . 1 . 2]" 1
923 1 86 VAL MG1 1 87 ASN H . . 3.860 3.959 3.867 4.014 0.154 2 0 "[ . 1 . 2]" 1
924 1 86 VAL MG1 1 88 GLY H . . 4.960 4.449 3.735 4.770 . 0 0 "[ . 1 . 2]" 1
925 1 86 VAL MG2 1 87 ASN H . . 3.860 2.599 2.439 2.791 . 0 0 "[ . 1 . 2]" 1
926 1 86 VAL MG2 1 88 GLY H . . 4.960 4.421 4.244 4.602 . 0 0 "[ . 1 . 2]" 1
927 1 87 ASN H 1 87 ASN HD22 . . 5.270 5.077 4.303 5.478 0.208 10 0 "[ . 1 . 2]" 1
928 1 87 ASN H 1 88 GLY H . . 3.840 2.897 2.596 3.735 . 0 0 "[ . 1 . 2]" 1
929 1 87 ASN H 1 89 VAL H . . 4.860 4.363 4.162 4.654 . 0 0 "[ . 1 . 2]" 1
930 1 87 ASN H 1 112 VAL QG . . 4.630 3.036 2.364 3.964 . 0 0 "[ . 1 . 2]" 1
931 1 87 ASN H 1 113 SER H . . 4.410 3.020 2.561 3.278 . 0 0 "[ . 1 . 2]" 1
932 1 87 ASN H 1 113 SER HA . . 4.380 4.422 4.291 4.495 0.115 11 0 "[ . 1 . 2]" 1
933 1 87 ASN H 1 113 SER HB2 . . 4.650 3.401 2.321 4.706 0.056 13 0 "[ . 1 . 2]" 1
934 1 87 ASN H 1 113 SER HB3 . . 4.650 3.648 2.603 4.443 . 0 0 "[ . 1 . 2]" 1
935 1 87 ASN H 1 115 LEU H . . 5.120 4.723 4.296 5.144 0.024 18 0 "[ . 1 . 2]" 1
936 1 87 ASN HA 1 89 VAL H . . 5.000 4.668 4.396 5.074 0.074 3 0 "[ . 1 . 2]" 1
937 1 87 ASN HA 1 113 SER H . . 4.180 2.528 1.923 3.375 . 0 0 "[ . 1 . 2]" 1
938 1 87 ASN HA 1 113 SER HB2 . . 4.060 3.012 2.112 4.103 0.043 20 0 "[ . 1 . 2]" 1
939 1 87 ASN HA 1 113 SER HB3 . . 4.060 3.642 2.344 4.198 0.138 14 0 "[ . 1 . 2]" 1
940 1 87 ASN QB 1 89 VAL H . . 4.630 3.639 3.213 3.988 . 0 0 "[ . 1 . 2]" 1
941 1 87 ASN QB 1 102 LEU QD . . 5.130 2.581 2.129 3.400 . 0 0 "[ . 1 . 2]" 1
942 1 87 ASN QB 1 102 LEU HG . . 5.200 4.359 3.191 5.261 0.061 13 0 "[ . 1 . 2]" 1
943 1 87 ASN HD21 1 112 VAL MG1 . . 5.170 2.919 1.717 4.791 . 0 0 "[ . 1 . 2]" 1
944 1 87 ASN HD21 1 112 VAL QG . . 4.340 2.604 1.581 4.376 0.036 15 0 "[ . 1 . 2]" 1
945 1 87 ASN HD21 1 112 VAL MG2 . . 5.170 3.191 1.810 5.057 . 0 0 "[ . 1 . 2]" 1
946 1 87 ASN HD22 1 106 THR MG . . 5.280 4.558 3.528 5.286 0.006 17 0 "[ . 1 . 2]" 1
947 1 87 ASN HD22 1 112 VAL H . . 5.500 5.385 4.343 5.666 0.166 18 0 "[ . 1 . 2]" 1
948 1 87 ASN HD22 1 112 VAL QG . . 4.560 2.535 1.630 3.531 . 0 0 "[ . 1 . 2]" 1
949 1 87 ASN HD22 1 113 SER H . . 4.610 3.723 2.330 4.632 0.022 18 0 "[ . 1 . 2]" 1
950 1 88 GLY H 1 89 VAL H . . 3.820 2.226 1.577 2.538 . 0 0 "[ . 1 . 2]" 1
951 1 89 VAL H 1 89 VAL HB . . 3.460 2.608 2.476 2.759 . 0 0 "[ . 1 . 2]" 1
952 1 89 VAL H 1 89 VAL MG1 . . 3.920 3.830 3.770 3.883 . 0 0 "[ . 1 . 2]" 1
953 1 89 VAL H 1 89 VAL QG . . 3.100 2.517 2.282 2.718 . 0 0 "[ . 1 . 2]" 1
954 1 89 VAL H 1 89 VAL MG2 . . 3.920 2.555 2.301 2.778 . 0 0 "[ . 1 . 2]" 1
955 1 89 VAL H 1 90 ASP H . . 4.820 4.429 4.303 4.547 . 0 0 "[ . 1 . 2]" 1
956 1 89 VAL H 1 102 LEU MD1 . . 4.750 4.070 3.634 4.582 . 0 0 "[ . 1 . 2]" 1
957 1 89 VAL H 1 102 LEU QD . . 4.120 3.448 2.905 3.921 . 0 0 "[ . 1 . 2]" 1
958 1 89 VAL H 1 102 LEU MD2 . . 4.750 3.741 3.055 4.501 . 0 0 "[ . 1 . 2]" 1
959 1 89 VAL HA 1 89 VAL MG1 . . 3.440 2.402 2.333 2.454 . 0 0 "[ . 1 . 2]" 1
960 1 89 VAL HA 1 89 VAL QG . . 2.900 2.132 2.114 2.151 . 0 0 "[ . 1 . 2]" 1
961 1 89 VAL HA 1 89 VAL MG2 . . 3.440 2.385 2.349 2.440 . 0 0 "[ . 1 . 2]" 1
962 1 89 VAL HA 1 90 ASP H . . 3.140 2.185 2.108 2.324 . 0 0 "[ . 1 . 2]" 1
963 1 89 VAL HA 1 90 ASP QB . . 4.580 4.192 3.891 4.485 . 0 0 "[ . 1 . 2]" 1
964 1 89 VAL HA 1 94 LYS QE . . 5.000 4.720 4.432 4.999 . 0 0 "[ . 1 . 2]" 1
965 1 89 VAL HB 1 90 ASP H . . 4.890 4.038 3.810 4.164 . 0 0 "[ . 1 . 2]" 1
966 1 89 VAL HB 1 91 LEU QD . . 4.830 3.611 3.006 4.196 . 0 0 "[ . 1 . 2]" 1
967 1 89 VAL HB 1 102 LEU MD1 . . 4.860 2.932 2.472 3.479 . 0 0 "[ . 1 . 2]" 1
968 1 89 VAL HB 1 102 LEU MD2 . . 4.860 1.986 1.860 2.228 . 0 0 "[ . 1 . 2]" 1
969 1 89 VAL HB 1 102 LEU HG . . 4.710 4.397 4.081 4.838 0.128 20 0 "[ . 1 . 2]" 1
970 1 89 VAL QG 1 90 ASP H . . 3.320 2.438 2.161 2.640 . 0 0 "[ . 1 . 2]" 1
971 1 89 VAL QG 1 91 LEU HA . . 4.460 4.030 3.709 4.373 . 0 0 "[ . 1 . 2]" 1
972 1 89 VAL QG 1 94 LYS QB . . 4.470 4.448 4.220 4.530 0.060 8 0 "[ . 1 . 2]" 1
973 1 89 VAL QG 1 94 LYS QE . . 3.030 1.986 1.849 2.161 . 0 0 "[ . 1 . 2]" 1
974 1 89 VAL QG 1 94 LYS QG . . 4.190 3.808 3.686 3.965 . 0 0 "[ . 1 . 2]" 1
975 1 89 VAL QG 1 102 LEU QD . . 2.390 1.986 1.814 2.153 . 0 0 "[ . 1 . 2]" 1
976 1 89 VAL MG1 1 90 ASP H . . 3.900 2.463 2.171 2.681 . 0 0 "[ . 1 . 2]" 1
977 1 89 VAL MG2 1 90 ASP H . . 3.900 3.948 3.919 3.973 0.073 20 0 "[ . 1 . 2]" 1
978 1 90 ASP H 1 90 ASP QB . . 3.230 2.410 2.254 2.810 . 0 0 "[ . 1 . 2]" 1
979 1 90 ASP H 1 91 LEU H . . 4.950 4.516 4.447 4.625 . 0 0 "[ . 1 . 2]" 1
980 1 90 ASP H 1 94 LYS QE . . 4.390 3.856 3.455 4.054 . 0 0 "[ . 1 . 2]" 1
981 1 90 ASP H 1 94 LYS QG . . 5.110 5.203 5.076 5.274 0.164 8 0 "[ . 1 . 2]" 1
982 1 90 ASP HA 1 91 LEU H . . 3.520 2.177 2.102 2.267 . 0 0 "[ . 1 . 2]" 1
983 1 90 ASP HA 1 92 VAL H . . 4.350 4.100 3.595 4.386 0.036 8 0 "[ . 1 . 2]" 1
984 1 90 ASP QB 1 91 LEU H . . 4.410 3.176 2.494 3.723 . 0 0 "[ . 1 . 2]" 1
985 1 90 ASP QB 1 92 VAL H . . 4.610 3.899 3.022 4.681 0.071 20 0 "[ . 1 . 2]" 1
986 1 91 LEU H 1 91 LEU QB . . 3.510 2.559 2.494 2.647 . 0 0 "[ . 1 . 2]" 1
987 1 91 LEU H 1 91 LEU QD . . 4.120 2.890 2.709 3.172 . 0 0 "[ . 1 . 2]" 1
988 1 91 LEU H 1 91 LEU HG . . 3.710 2.288 2.053 2.641 . 0 0 "[ . 1 . 2]" 1
989 1 91 LEU H 1 92 VAL H . . 3.880 2.194 1.977 2.379 . 0 0 "[ . 1 . 2]" 1
990 1 91 LEU H 1 92 VAL QG . . 4.780 3.426 2.732 3.899 . 0 0 "[ . 1 . 2]" 1
991 1 91 LEU H 1 94 LYS QG . . 5.200 4.413 4.197 4.681 . 0 0 "[ . 1 . 2]" 1
992 1 91 LEU HA 1 91 LEU MD1 . . 3.840 3.773 3.700 3.845 0.005 10 0 "[ . 1 . 2]" 1
993 1 91 LEU HA 1 91 LEU QD . . 3.090 2.121 2.011 2.282 . 0 0 "[ . 1 . 2]" 1
994 1 91 LEU HA 1 91 LEU MD2 . . 3.840 2.132 2.019 2.300 . 0 0 "[ . 1 . 2]" 1
995 1 91 LEU HA 1 91 LEU HG . . 3.560 3.333 3.225 3.420 . 0 0 "[ . 1 . 2]" 1
996 1 91 LEU HA 1 94 LYS QD . . 4.800 2.717 2.529 3.113 . 0 0 "[ . 1 . 2]" 1
997 1 91 LEU HA 1 94 LYS QE . . 3.930 3.629 3.391 3.778 . 0 0 "[ . 1 . 2]" 1
998 1 91 LEU HA 1 94 LYS QG . . 4.160 2.222 1.980 2.495 . 0 0 "[ . 1 . 2]" 1
999 1 91 LEU HA 1 99 VAL MG1 . . 5.110 4.217 3.942 4.475 . 0 0 "[ . 1 . 2]" 1
1000 1 91 LEU HA 1 99 VAL QG . . 4.420 2.775 2.470 3.086 . 0 0 "[ . 1 . 2]" 1
1001 1 91 LEU HA 1 99 VAL MG2 . . 5.110 2.815 2.493 3.149 . 0 0 "[ . 1 . 2]" 1
1002 1 91 LEU QB 1 92 VAL H . . 4.310 2.455 2.233 2.827 . 0 0 "[ . 1 . 2]" 1
1003 1 91 LEU QB 1 94 LYS QG . . 4.410 3.500 3.252 3.808 . 0 0 "[ . 1 . 2]" 1
1004 1 91 LEU QB 1 99 VAL QG . . 4.260 2.434 2.105 2.898 . 0 0 "[ . 1 . 2]" 1
1005 1 91 LEU QD 1 92 VAL H . . 5.300 3.849 3.775 3.956 . 0 0 "[ . 1 . 2]" 1
1006 1 91 LEU QD 1 92 VAL QG . . 3.500 3.621 3.541 3.687 0.187 5 0 "[ . 1 . 2]" 1
1007 1 91 LEU QD 1 94 LYS QD . . 4.420 2.836 2.507 3.380 . 0 0 "[ . 1 . 2]" 1
1008 1 91 LEU QD 1 94 LYS QE . . 3.710 3.715 3.347 3.833 0.123 14 0 "[ . 1 . 2]" 1
1009 1 91 LEU QD 1 99 VAL H . . 5.060 4.620 4.399 4.993 . 0 0 "[ . 1 . 2]" 1
1010 1 91 LEU QD 1 99 VAL HA . . 4.850 3.368 2.900 3.745 . 0 0 "[ . 1 . 2]" 1
1011 1 91 LEU QD 1 99 VAL QG . . 2.460 1.688 1.601 1.797 . 0 0 "[ . 1 . 2]" 1
1012 1 92 VAL H 1 92 VAL HB . . 3.330 2.671 2.449 3.515 0.185 16 0 "[ . 1 . 2]" 1
1013 1 92 VAL H 1 92 VAL MG1 . . 3.960 3.516 2.035 3.799 . 0 0 "[ . 1 . 2]" 1
1014 1 92 VAL H 1 92 VAL QG . . 3.090 2.035 1.707 2.268 . 0 0 "[ . 1 . 2]" 1
1015 1 92 VAL H 1 92 VAL MG2 . . 3.960 2.065 1.833 2.287 . 0 0 "[ . 1 . 2]" 1
1016 1 92 VAL H 1 93 GLY H . . 4.720 3.759 2.552 4.324 . 0 0 "[ . 1 . 2]" 1
1017 1 92 VAL HA 1 92 VAL MG1 . . 3.540 2.388 2.218 2.469 . 0 0 "[ . 1 . 2]" 1
1018 1 92 VAL HA 1 92 VAL QG . . 3.080 2.149 2.093 2.287 . 0 0 "[ . 1 . 2]" 1
1019 1 92 VAL HA 1 92 VAL MG2 . . 3.540 2.510 2.262 3.217 . 0 0 "[ . 1 . 2]" 1
1020 1 92 VAL HA 1 93 GLY H . . 3.560 2.385 1.976 3.498 . 0 0 "[ . 1 . 2]" 1
1021 1 92 VAL HA 1 94 LYS H . . 4.500 3.554 3.285 3.906 . 0 0 "[ . 1 . 2]" 1
1022 1 92 VAL HB 1 93 GLY H . . 4.760 4.132 2.789 4.446 . 0 0 "[ . 1 . 2]" 1
1023 1 92 VAL QG 1 93 GLY H . . 3.660 3.216 2.888 3.586 . 0 0 "[ . 1 . 2]" 1
1024 1 92 VAL QG 1 93 GLY HA2 . . 4.890 3.830 3.611 4.586 . 0 0 "[ . 1 . 2]" 1
1025 1 92 VAL QG 1 94 LYS H . . 4.900 4.445 4.298 4.631 . 0 0 "[ . 1 . 2]" 1
1026 1 92 VAL MG1 1 93 GLY H . . 4.310 3.489 2.958 4.218 . 0 0 "[ . 1 . 2]" 1
1027 1 92 VAL MG2 1 93 GLY H . . 4.310 3.992 3.012 4.226 . 0 0 "[ . 1 . 2]" 1
1028 1 93 GLY H 1 94 LYS H . . 3.940 2.126 1.696 2.787 . 0 0 "[ . 1 . 2]" 1
1029 1 94 LYS H 1 94 LYS HB2 . . 4.030 3.785 3.706 3.931 . 0 0 "[ . 1 . 2]" 1
1030 1 94 LYS H 1 94 LYS QB . . 3.420 3.004 2.888 3.216 . 0 0 "[ . 1 . 2]" 1
1031 1 94 LYS H 1 94 LYS HB3 . . 4.030 3.153 3.011 3.419 . 0 0 "[ . 1 . 2]" 1
1032 1 94 LYS H 1 94 LYS QE . . 4.980 4.632 4.349 4.987 0.007 5 0 "[ . 1 . 2]" 1
1033 1 94 LYS H 1 94 LYS QG . . 3.770 2.370 2.241 2.633 . 0 0 "[ . 1 . 2]" 1
1034 1 94 LYS H 1 95 SER H . . 5.090 4.422 4.320 4.510 . 0 0 "[ . 1 . 2]" 1
1035 1 94 LYS H 1 99 VAL QG . . 4.940 4.589 4.386 4.755 . 0 0 "[ . 1 . 2]" 1
1036 1 94 LYS HA 1 94 LYS QD . . 4.640 4.510 4.452 4.574 . 0 0 "[ . 1 . 2]" 1
1037 1 94 LYS HA 1 94 LYS QG . . 3.720 3.395 3.349 3.442 . 0 0 "[ . 1 . 2]" 1
1038 1 94 LYS HA 1 95 SER H . . 3.410 2.559 2.411 2.645 . 0 0 "[ . 1 . 2]" 1
1039 1 94 LYS HA 1 98 GLU HB2 . . 5.050 4.970 4.454 5.137 0.087 18 0 "[ . 1 . 2]" 1
1040 1 94 LYS QB 1 94 LYS QD . . 3.120 2.297 2.209 2.351 . 0 0 "[ . 1 . 2]" 1
1041 1 94 LYS QB 1 94 LYS QE . . 4.190 2.793 1.924 3.025 . 0 0 "[ . 1 . 2]" 1
1042 1 94 LYS QB 1 98 GLU HB2 . . 4.520 2.752 2.247 2.938 . 0 0 "[ . 1 . 2]" 1
1043 1 94 LYS QB 1 99 VAL QG . . 4.340 3.838 3.444 4.051 . 0 0 "[ . 1 . 2]" 1
1044 1 94 LYS HB2 1 95 SER H . . 4.450 2.084 1.912 2.439 . 0 0 "[ . 1 . 2]" 1
1045 1 94 LYS HB3 1 95 SER H . . 4.450 3.528 3.397 3.772 . 0 0 "[ . 1 . 2]" 1
1046 1 94 LYS QD 1 99 VAL H . . 4.800 3.524 3.100 3.830 . 0 0 "[ . 1 . 2]" 1
1047 1 94 LYS QD 1 99 VAL QG . . 3.690 2.266 1.933 2.542 . 0 0 "[ . 1 . 2]" 1
1048 1 94 LYS HD2 1 99 VAL MG1 . . 6.070 4.061 3.582 4.373 . 0 0 "[ . 1 . 2]" 1
1049 1 94 LYS HD2 1 99 VAL MG2 . . 6.070 2.379 1.980 2.751 . 0 0 "[ . 1 . 2]" 1
1050 1 94 LYS HD3 1 99 VAL MG1 . . 6.070 4.915 4.246 5.143 . 0 0 "[ . 1 . 2]" 1
1051 1 94 LYS HD3 1 99 VAL MG2 . . 6.070 2.971 2.516 3.330 . 0 0 "[ . 1 . 2]" 1
1052 1 94 LYS QE 1 94 LYS QG . . 3.280 2.411 2.289 2.505 . 0 0 "[ . 1 . 2]" 1
1053 1 94 LYS QG 1 95 SER H . . 4.710 3.411 3.153 3.765 . 0 0 "[ . 1 . 2]" 1
1054 1 94 LYS QG 1 98 GLU HB2 . . 4.830 3.350 3.105 3.658 . 0 0 "[ . 1 . 2]" 1
1055 1 95 SER H 1 95 SER QB . . 3.660 2.448 2.266 2.819 . 0 0 "[ . 1 . 2]" 1
1056 1 95 SER H 1 98 GLU H . . 4.560 4.010 3.808 4.120 . 0 0 "[ . 1 . 2]" 1
1057 1 95 SER H 1 98 GLU HB2 . . 3.870 3.029 2.807 3.145 . 0 0 "[ . 1 . 2]" 1
1058 1 95 SER H 1 98 GLU HB3 . . 4.230 4.212 4.019 4.281 0.051 18 0 "[ . 1 . 2]" 1
1059 1 95 SER H 1 98 GLU HG2 . . 4.960 4.210 2.641 4.454 . 0 0 "[ . 1 . 2]" 1
1060 1 95 SER H 1 99 VAL QG . . 5.440 4.315 4.124 4.473 . 0 0 "[ . 1 . 2]" 1
1061 1 95 SER HA 1 97 GLU H . . 4.550 4.453 4.100 4.591 0.041 17 0 "[ . 1 . 2]" 1
1062 1 95 SER QB 1 96 GLN H . . 3.560 2.568 2.346 3.418 . 0 0 "[ . 1 . 2]" 1
1063 1 95 SER QB 1 97 GLU H . . 3.690 2.981 2.658 3.212 . 0 0 "[ . 1 . 2]" 1
1064 1 95 SER QB 1 98 GLU H . . 4.670 2.988 2.579 3.708 . 0 0 "[ . 1 . 2]" 1
1065 1 95 SER QB 1 98 GLU HG2 . . 5.340 4.056 2.135 5.349 0.009 2 0 "[ . 1 . 2]" 1
1066 1 95 SER HB2 1 96 GLN H . . 4.180 3.514 2.375 3.861 . 0 0 "[ . 1 . 2]" 1
1067 1 95 SER HB2 1 97 GLU H . . 4.220 3.561 2.683 4.289 0.069 14 0 "[ . 1 . 2]" 1
1068 1 95 SER HB3 1 96 GLN H . . 4.180 2.776 2.424 3.812 . 0 0 "[ . 1 . 2]" 1
1069 1 95 SER HB3 1 97 GLU H . . 4.220 3.333 3.043 4.316 0.096 2 0 "[ . 1 . 2]" 1
1070 1 96 GLN H 1 96 GLN HB2 . . 3.900 2.357 2.047 2.567 . 0 0 "[ . 1 . 2]" 1
1071 1 96 GLN H 1 96 GLN QB . . 3.360 2.235 1.996 2.516 . 0 0 "[ . 1 . 2]" 1
1072 1 96 GLN H 1 96 GLN HB3 . . 3.900 3.010 2.455 3.617 . 0 0 "[ . 1 . 2]" 1
1073 1 96 GLN H 1 96 GLN QG . . 5.020 3.238 2.132 4.008 . 0 0 "[ . 1 . 2]" 1
1074 1 96 GLN H 1 97 GLU H . . 3.870 2.802 2.609 2.972 . 0 0 "[ . 1 . 2]" 1
1075 1 96 GLN HA 1 98 GLU H . . 4.940 4.269 4.166 4.467 . 0 0 "[ . 1 . 2]" 1
1076 1 96 GLN HA 1 99 VAL H . . 4.320 3.431 3.256 3.690 . 0 0 "[ . 1 . 2]" 1
1077 1 96 GLN HA 1 99 VAL HB . . 4.410 3.018 2.792 3.415 . 0 0 "[ . 1 . 2]" 1
1078 1 96 GLN HA 1 99 VAL MG1 . . 5.420 4.265 4.094 4.491 . 0 0 "[ . 1 . 2]" 1
1079 1 96 GLN HA 1 99 VAL QG . . 4.100 2.617 2.285 2.839 . 0 0 "[ . 1 . 2]" 1
1080 1 96 GLN HA 1 99 VAL MG2 . . 5.420 2.642 2.296 2.882 . 0 0 "[ . 1 . 2]" 1
1081 1 96 GLN HA 1 100 VAL H . . 4.970 4.177 3.789 4.890 . 0 0 "[ . 1 . 2]" 1
1082 1 96 GLN HA 1 100 VAL MG1 . . 4.920 3.880 3.379 4.781 . 0 0 "[ . 1 . 2]" 1
1083 1 96 GLN QB 1 97 GLU H . . 3.040 2.430 2.235 2.623 . 0 0 "[ . 1 . 2]" 1
1084 1 96 GLN QB 1 100 VAL MG2 . . 5.130 4.651 4.141 5.184 0.054 6 0 "[ . 1 . 2]" 1
1085 1 96 GLN HB2 1 97 GLU H . . 3.690 3.200 2.430 3.745 0.055 11 0 "[ . 1 . 2]" 1
1086 1 96 GLN HB3 1 97 GLU H . . 3.690 2.812 2.256 3.457 . 0 0 "[ . 1 . 2]" 1
1087 1 96 GLN QE 1 100 VAL MG1 . . 4.660 4.185 3.351 4.723 0.063 19 0 "[ . 1 . 2]" 1
1088 1 96 GLN QG 1 99 VAL QG . . 3.920 3.933 3.664 4.076 0.156 2 0 "[ . 1 . 2]" 1
1089 1 97 GLU H 1 97 GLU HB2 . . 3.900 2.507 2.382 2.778 . 0 0 "[ . 1 . 2]" 1
1090 1 97 GLU H 1 97 GLU QB . . 3.330 2.462 2.349 2.698 . 0 0 "[ . 1 . 2]" 1
1091 1 97 GLU H 1 97 GLU HB3 . . 3.900 3.617 3.543 3.662 . 0 0 "[ . 1 . 2]" 1
1092 1 97 GLU H 1 97 GLU HG2 . . 4.530 3.427 2.153 3.852 . 0 0 "[ . 1 . 2]" 1
1093 1 97 GLU H 1 97 GLU QG . . 3.660 2.366 2.071 3.110 . 0 0 "[ . 1 . 2]" 1
1094 1 97 GLU H 1 97 GLU HG3 . . 4.530 2.555 2.087 3.732 . 0 0 "[ . 1 . 2]" 1
1095 1 97 GLU H 1 98 GLU H . . 3.640 2.692 2.559 2.780 . 0 0 "[ . 1 . 2]" 1
1096 1 97 GLU H 1 100 VAL MG1 . . 5.060 4.259 3.897 4.815 . 0 0 "[ . 1 . 2]" 1
1097 1 97 GLU HA 1 97 GLU HG2 . . 4.080 2.759 2.354 3.713 . 0 0 "[ . 1 . 2]" 1
1098 1 97 GLU HA 1 97 GLU HG3 . . 4.080 2.911 2.435 3.705 . 0 0 "[ . 1 . 2]" 1
1099 1 97 GLU HA 1 100 VAL H . . 4.010 3.162 2.858 3.393 . 0 0 "[ . 1 . 2]" 1
1100 1 97 GLU HA 1 100 VAL MG1 . . 3.750 2.790 2.468 2.954 . 0 0 "[ . 1 . 2]" 1
1101 1 97 GLU HA 1 100 VAL MG2 . . 3.310 1.928 1.835 2.048 . 0 0 "[ . 1 . 2]" 1
1102 1 97 GLU HA 1 101 SER H . . 5.100 3.889 3.739 4.076 . 0 0 "[ . 1 . 2]" 1
1103 1 97 GLU QB 1 98 GLU H . . 3.380 2.786 2.631 3.016 . 0 0 "[ . 1 . 2]" 1
1104 1 97 GLU QB 1 100 VAL MG1 . . 4.620 4.483 4.206 4.633 0.013 13 0 "[ . 1 . 2]" 1
1105 1 97 GLU HB2 1 98 GLU H . . 3.960 2.867 2.693 3.150 . 0 0 "[ . 1 . 2]" 1
1106 1 97 GLU HB2 1 100 VAL MG1 . . 5.330 5.283 4.967 5.385 0.055 20 0 "[ . 1 . 2]" 1
1107 1 97 GLU HB3 1 98 GLU H . . 3.960 3.798 3.679 3.856 . 0 0 "[ . 1 . 2]" 1
1108 1 97 GLU HB3 1 100 VAL MG1 . . 5.330 4.848 4.541 5.066 . 0 0 "[ . 1 . 2]" 1
1109 1 97 GLU QG 1 100 VAL MG1 . . 3.940 3.950 3.551 4.071 0.131 1 0 "[ . 1 . 2]" 1
1110 1 98 GLU H 1 98 GLU HB2 . . 3.280 2.374 2.305 2.431 . 0 0 "[ . 1 . 2]" 1
1111 1 98 GLU H 1 98 GLU HG2 . . 3.920 3.417 2.083 3.548 . 0 0 "[ . 1 . 2]" 1
1112 1 98 GLU H 1 98 GLU HG3 . . 4.650 2.335 2.183 3.553 . 0 0 "[ . 1 . 2]" 1
1113 1 98 GLU H 1 99 VAL H . . 3.610 2.513 2.428 2.628 . 0 0 "[ . 1 . 2]" 1
1114 1 98 GLU H 1 99 VAL QG . . 4.670 3.709 3.552 3.839 . 0 0 "[ . 1 . 2]" 1
1115 1 98 GLU H 1 100 VAL H . . 4.450 3.960 3.869 4.116 . 0 0 "[ . 1 . 2]" 1
1116 1 98 GLU HA 1 98 GLU HG2 . . 3.860 2.597 2.549 3.169 . 0 0 "[ . 1 . 2]" 1
1117 1 98 GLU HA 1 100 VAL H . . 5.070 4.450 4.294 4.573 . 0 0 "[ . 1 . 2]" 1
1118 1 98 GLU HA 1 101 SER H . . 4.470 3.761 3.441 3.942 . 0 0 "[ . 1 . 2]" 1
1119 1 98 GLU HA 1 102 LEU QB . . 4.940 4.747 4.553 4.973 0.033 18 0 "[ . 1 . 2]" 1
1120 1 98 GLU HB2 1 99 VAL H . . 4.020 2.544 2.429 2.651 . 0 0 "[ . 1 . 2]" 1
1121 1 98 GLU HB2 1 99 VAL QG . . 4.930 3.027 2.905 3.224 . 0 0 "[ . 1 . 2]" 1
1122 1 98 GLU HB2 1 100 VAL H . . 4.820 4.881 4.851 4.921 0.101 13 0 "[ . 1 . 2]" 1
1123 1 98 GLU HB3 1 98 GLU HG2 . . 2.920 2.479 2.436 2.985 0.065 14 0 "[ . 1 . 2]" 1
1124 1 98 GLU HB3 1 99 VAL H . . 4.280 3.611 3.466 3.712 . 0 0 "[ . 1 . 2]" 1
1125 1 98 GLU HG2 1 99 VAL H . . 5.350 4.914 4.013 5.053 . 0 0 "[ . 1 . 2]" 1
1126 1 99 VAL H 1 99 VAL HB . . 3.510 2.648 2.555 2.731 . 0 0 "[ . 1 . 2]" 1
1127 1 99 VAL H 1 99 VAL MG1 . . 3.980 3.781 3.756 3.809 . 0 0 "[ . 1 . 2]" 1
1128 1 99 VAL H 1 99 VAL QG . . 3.210 2.003 1.908 2.076 . 0 0 "[ . 1 . 2]" 1
1129 1 99 VAL H 1 99 VAL MG2 . . 3.980 2.010 1.914 2.086 . 0 0 "[ . 1 . 2]" 1
1130 1 99 VAL H 1 100 VAL H . . 3.680 2.510 2.420 2.625 . 0 0 "[ . 1 . 2]" 1
1131 1 99 VAL H 1 101 SER H . . 4.120 4.125 4.048 4.161 0.041 11 0 "[ . 1 . 2]" 1
1132 1 99 VAL HA 1 99 VAL MG1 . . 3.500 2.347 2.305 2.379 . 0 0 "[ . 1 . 2]" 1
1133 1 99 VAL HA 1 99 VAL QG . . 3.030 2.159 2.145 2.180 . 0 0 "[ . 1 . 2]" 1
1134 1 99 VAL HA 1 99 VAL MG2 . . 3.500 2.526 2.451 2.614 . 0 0 "[ . 1 . 2]" 1
1135 1 99 VAL HA 1 102 LEU H . . 3.920 3.408 3.292 3.526 . 0 0 "[ . 1 . 2]" 1
1136 1 99 VAL HA 1 102 LEU HB2 . . 4.620 3.593 3.051 4.766 0.146 20 0 "[ . 1 . 2]" 1
1137 1 99 VAL HA 1 102 LEU QB . . 3.760 2.587 2.102 3.782 0.022 8 0 "[ . 1 . 2]" 1
1138 1 99 VAL HA 1 102 LEU HB3 . . 4.620 2.659 2.133 3.982 . 0 0 "[ . 1 . 2]" 1
1139 1 99 VAL HA 1 102 LEU MD1 . . 4.600 4.295 2.955 4.673 0.073 14 0 "[ . 1 . 2]" 1
1140 1 99 VAL HA 1 102 LEU MD2 . . 4.600 2.363 2.053 2.605 . 0 0 "[ . 1 . 2]" 1
1141 1 99 VAL HA 1 102 LEU HG . . 4.390 3.599 1.920 4.276 . 0 0 "[ . 1 . 2]" 1
1142 1 99 VAL HB 1 100 VAL H . . 3.210 2.655 2.527 2.769 . 0 0 "[ . 1 . 2]" 1
1143 1 99 VAL MG1 1 100 VAL H . . 4.550 3.664 3.534 3.763 . 0 0 "[ . 1 . 2]" 1
1144 1 99 VAL MG2 1 100 VAL H . . 4.550 3.685 3.551 3.799 . 0 0 "[ . 1 . 2]" 1
1145 1 100 VAL H 1 100 VAL HB . . 3.720 3.724 3.701 3.760 0.040 6 0 "[ . 1 . 2]" 1
1146 1 100 VAL H 1 100 VAL MG1 . . 3.250 2.239 2.165 2.389 . 0 0 "[ . 1 . 2]" 1
1147 1 100 VAL H 1 100 VAL MG2 . . 3.840 2.493 2.330 2.601 . 0 0 "[ . 1 . 2]" 1
1148 1 100 VAL H 1 101 SER H . . 3.650 2.614 2.503 2.684 . 0 0 "[ . 1 . 2]" 1
1149 1 100 VAL HA 1 100 VAL MG1 . . 3.280 2.489 2.423 2.537 . 0 0 "[ . 1 . 2]" 1
1150 1 100 VAL HA 1 100 VAL MG2 . . 3.430 3.236 3.220 3.254 . 0 0 "[ . 1 . 2]" 1
1151 1 100 VAL HA 1 103 LEU H . . 4.370 3.175 2.925 3.449 . 0 0 "[ . 1 . 2]" 1
1152 1 100 VAL HA 1 103 LEU HB2 . . 4.710 3.196 2.679 3.630 . 0 0 "[ . 1 . 2]" 1
1153 1 100 VAL HA 1 103 LEU HB3 . . 4.900 2.389 2.037 2.643 . 0 0 "[ . 1 . 2]" 1
1154 1 100 VAL HA 1 103 LEU QD . . 4.160 3.012 2.587 3.376 . 0 0 "[ . 1 . 2]" 1
1155 1 100 VAL HA 1 104 ARG H . . 5.000 3.893 3.755 4.093 . 0 0 "[ . 1 . 2]" 1
1156 1 100 VAL HB 1 101 SER H . . 3.710 3.801 3.763 3.828 0.118 20 0 "[ . 1 . 2]" 1
1157 1 100 VAL HB 1 104 ARG HG2 . . 3.800 3.411 3.186 3.897 0.097 4 0 "[ . 1 . 2]" 1
1158 1 100 VAL MG1 1 101 SER H . . 4.170 3.828 3.763 3.929 . 0 0 "[ . 1 . 2]" 1
1159 1 100 VAL MG1 1 104 ARG QD . . 4.970 4.831 4.517 5.043 0.073 9 0 "[ . 1 . 2]" 1
1160 1 100 VAL MG1 1 104 ARG HG3 . . 5.500 5.435 4.832 5.560 0.060 15 0 "[ . 1 . 2]" 1
1161 1 100 VAL MG2 1 101 SER H . . 3.980 2.176 2.073 2.270 . 0 0 "[ . 1 . 2]" 1
1162 1 100 VAL MG2 1 104 ARG H . . 5.200 4.603 4.509 4.759 . 0 0 "[ . 1 . 2]" 1
1163 1 100 VAL MG2 1 104 ARG QD . . 3.930 3.911 3.049 4.049 0.119 20 0 "[ . 1 . 2]" 1
1164 1 100 VAL MG2 1 104 ARG HG2 . . 4.310 3.536 3.266 4.331 0.021 16 0 "[ . 1 . 2]" 1
1165 1 100 VAL MG2 1 104 ARG HG3 . . 4.250 3.516 3.322 3.779 . 0 0 "[ . 1 . 2]" 1
1166 1 101 SER HA 1 104 ARG H . . 3.850 3.305 3.038 3.528 . 0 0 "[ . 1 . 2]" 1
1167 1 101 SER HA 1 104 ARG HB2 . . 3.750 2.668 2.414 3.081 . 0 0 "[ . 1 . 2]" 1
1168 1 101 SER HA 1 104 ARG QD . . 4.730 4.483 3.304 4.777 0.047 20 0 "[ . 1 . 2]" 1
1169 1 101 SER HA 1 104 ARG HG2 . . 4.230 3.168 2.737 4.263 0.033 4 0 "[ . 1 . 2]" 1
1170 1 101 SER HA 1 104 ARG HG3 . . 4.140 3.012 2.609 3.437 . 0 0 "[ . 1 . 2]" 1
1171 1 101 SER QB 1 102 LEU H . . 3.870 2.609 2.415 3.493 . 0 0 "[ . 1 . 2]" 1
1172 1 102 LEU H 1 102 LEU HB2 . . 3.940 2.744 2.373 3.661 . 0 0 "[ . 1 . 2]" 1
1173 1 102 LEU H 1 102 LEU QB . . 3.390 2.112 1.955 2.533 . 0 0 "[ . 1 . 2]" 1
1174 1 102 LEU H 1 102 LEU HB3 . . 3.940 2.214 2.057 2.585 . 0 0 "[ . 1 . 2]" 1
1175 1 102 LEU H 1 102 LEU HG . . 4.100 3.767 2.313 4.214 0.114 14 0 "[ . 1 . 2]" 1
1176 1 102 LEU H 1 103 LEU H . . 3.630 2.610 2.472 2.714 . 0 0 "[ . 1 . 2]" 1
1177 1 102 LEU H 1 104 ARG H . . 5.020 4.105 3.989 4.201 . 0 0 "[ . 1 . 2]" 1
1178 1 102 LEU HA 1 102 LEU MD1 . . 4.230 2.661 2.212 3.601 . 0 0 "[ . 1 . 2]" 1
1179 1 102 LEU HA 1 102 LEU QD . . 3.360 2.599 2.200 3.391 0.031 8 0 "[ . 1 . 2]" 1
1180 1 102 LEU HA 1 102 LEU MD2 . . 4.230 3.967 3.874 4.176 . 0 0 "[ . 1 . 2]" 1
1181 1 102 LEU HA 1 102 LEU HG . . 3.980 3.513 3.284 3.910 . 0 0 "[ . 1 . 2]" 1
1182 1 102 LEU QB 1 103 LEU H . . 3.910 2.771 2.383 3.634 . 0 0 "[ . 1 . 2]" 1
1183 1 102 LEU HB2 1 103 LEU H . . 4.700 3.929 3.799 4.085 . 0 0 "[ . 1 . 2]" 1
1184 1 102 LEU HB3 1 103 LEU H . . 4.700 2.894 2.408 4.101 . 0 0 "[ . 1 . 2]" 1
1185 1 102 LEU QD 1 103 LEU H . . 3.860 3.457 2.331 3.879 0.019 9 0 "[ . 1 . 2]" 1
1186 1 102 LEU QD 1 105 SER H . . 5.360 4.891 4.691 5.149 . 0 0 "[ . 1 . 2]" 1
1187 1 103 LEU H 1 103 LEU HB2 . . 3.510 2.554 2.338 2.725 . 0 0 "[ . 1 . 2]" 1
1188 1 103 LEU H 1 103 LEU HB3 . . 4.180 2.355 2.175 2.524 . 0 0 "[ . 1 . 2]" 1
1189 1 103 LEU H 1 103 LEU HG . . 4.380 4.424 4.402 4.447 0.067 15 0 "[ . 1 . 2]" 1
1190 1 103 LEU H 1 104 ARG H . . 3.850 2.639 2.530 2.745 . 0 0 "[ . 1 . 2]" 1
1191 1 103 LEU HA 1 103 LEU QD . . 3.750 2.653 2.039 3.240 . 0 0 "[ . 1 . 2]" 1
1192 1 103 LEU HA 1 103 LEU HG . . 4.160 2.859 2.693 3.143 . 0 0 "[ . 1 . 2]" 1
1193 1 103 LEU HA 1 105 SER H . . 4.650 4.333 4.132 4.660 0.010 3 0 "[ . 1 . 2]" 1
1194 1 103 LEU HA 1 112 VAL QG . . 4.300 3.732 3.245 3.997 . 0 0 "[ . 1 . 2]" 1
1195 1 103 LEU HB2 1 104 ARG H . . 5.000 3.837 3.568 4.041 . 0 0 "[ . 1 . 2]" 1
1196 1 103 LEU HB3 1 104 ARG H . . 4.700 2.511 2.252 2.743 . 0 0 "[ . 1 . 2]" 1
1197 1 103 LEU HB3 1 105 SER H . . 5.420 4.930 4.717 5.180 . 0 0 "[ . 1 . 2]" 1
1198 1 103 LEU QD 1 104 ARG H . . 4.930 3.199 2.513 3.875 . 0 0 "[ . 1 . 2]" 1
1199 1 103 LEU HG 1 104 ARG HA . . 4.040 4.002 3.545 4.202 0.162 19 0 "[ . 1 . 2]" 1
1200 1 104 ARG H 1 104 ARG HB2 . . 3.600 2.597 2.517 2.762 . 0 0 "[ . 1 . 2]" 1
1201 1 104 ARG H 1 104 ARG QD . . 5.110 3.745 3.119 4.195 . 0 0 "[ . 1 . 2]" 1
1202 1 104 ARG H 1 104 ARG HG2 . . 4.470 2.285 2.115 3.208 . 0 0 "[ . 1 . 2]" 1
1203 1 104 ARG H 1 104 ARG HG3 . . 4.560 3.447 2.082 3.749 . 0 0 "[ . 1 . 2]" 1
1204 1 104 ARG H 1 105 SER H . . 3.950 2.687 2.577 2.863 . 0 0 "[ . 1 . 2]" 1
1205 1 104 ARG H 1 106 THR H . . 5.100 4.171 3.986 4.604 . 0 0 "[ . 1 . 2]" 1
1206 1 104 ARG HA 1 104 ARG QD . . 5.010 2.883 2.147 4.091 . 0 0 "[ . 1 . 2]" 1
1207 1 104 ARG HA 1 104 ARG HG3 . . 4.160 3.780 3.235 3.876 . 0 0 "[ . 1 . 2]" 1
1208 1 104 ARG HB2 1 104 ARG QD . . 3.750 3.441 2.961 3.522 . 0 0 "[ . 1 . 2]" 1
1209 1 104 ARG HB2 1 105 SER H . . 4.290 2.708 2.496 3.069 . 0 0 "[ . 1 . 2]" 1
1210 1 104 ARG HB3 1 104 ARG QD . . 3.410 2.702 2.471 3.055 . 0 0 "[ . 1 . 2]" 1
1211 1 105 SER H 1 105 SER QB . . 3.360 2.364 2.190 2.750 . 0 0 "[ . 1 . 2]" 1
1212 1 105 SER H 1 106 THR H . . 4.830 2.565 2.330 2.691 . 0 0 "[ . 1 . 2]" 1
1213 1 106 THR H 1 107 LYS H . . 5.290 4.124 2.876 4.615 . 0 0 "[ . 1 . 2]" 1
1214 1 106 THR HA 1 106 THR MG . . 3.510 2.425 2.325 2.500 . 0 0 "[ . 1 . 2]" 1
1215 1 106 THR HB 1 107 LYS H . . 5.160 2.638 1.828 4.198 . 0 0 "[ . 1 . 2]" 1
1216 1 106 THR HB 1 112 VAL QG . . 4.120 4.092 3.903 4.226 0.106 18 0 "[ . 1 . 2]" 1
1217 1 106 THR MG 1 107 LYS H . . 4.270 2.447 1.699 4.156 . 0 0 "[ . 1 . 2]" 1
1218 1 106 THR MG 1 110 GLY H . . 5.230 3.835 3.073 4.639 . 0 0 "[ . 1 . 2]" 1
1219 1 106 THR MG 1 110 GLY HA2 . . 4.880 2.867 2.094 3.609 . 0 0 "[ . 1 . 2]" 1
1220 1 106 THR MG 1 110 GLY QA . . 4.050 2.819 2.069 3.516 . 0 0 "[ . 1 . 2]" 1
1221 1 106 THR MG 1 110 GLY HA3 . . 4.880 4.209 3.227 4.903 0.023 7 0 "[ . 1 . 2]" 1
1222 1 106 THR MG 1 111 THR H . . 4.790 4.539 3.942 4.923 0.133 9 0 "[ . 1 . 2]" 1
1223 1 106 THR MG 1 111 THR HA . . 5.210 4.494 4.075 4.881 . 0 0 "[ . 1 . 2]" 1
1224 1 106 THR MG 1 112 VAL H . . 4.360 4.364 4.162 4.516 0.156 19 0 "[ . 1 . 2]" 1
1225 1 106 THR MG 1 112 VAL QG . . 3.070 1.903 1.796 2.158 . 0 0 "[ . 1 . 2]" 1
1226 1 107 LYS H 1 107 LYS QG . . 4.420 3.948 2.316 4.427 0.007 13 0 "[ . 1 . 2]" 1
1227 1 107 LYS HA 1 107 LYS QG . . 3.830 2.726 2.353 3.393 . 0 0 "[ . 1 . 2]" 1
1228 1 107 LYS QB 1 107 LYS QE . . 3.220 2.595 1.896 3.448 0.228 1 0 "[ . 1 . 2]" 1
1229 1 107 LYS QB 1 112 VAL QG . . 3.950 2.923 2.162 3.988 0.038 6 0 "[ . 1 . 2]" 1
1230 1 107 LYS QE 1 107 LYS QG . . 3.380 2.309 2.029 2.771 . 0 0 "[ . 1 . 2]" 1
1231 1 107 LYS QG 1 109 GLU H . . 4.990 2.201 1.669 4.556 . 0 0 "[ . 1 . 2]" 1
1232 1 107 LYS QG 1 110 GLY H . . 4.840 2.967 2.060 3.920 . 0 0 "[ . 1 . 2]" 1
1233 1 107 LYS QG 1 110 GLY QA . . 4.540 4.454 3.100 4.648 0.108 16 0 "[ . 1 . 2]" 1
1234 1 107 LYS QG 1 111 THR H . . 5.270 3.939 3.183 4.621 . 0 0 "[ . 1 . 2]" 1
1235 1 107 LYS QG 1 112 VAL QG . . 4.430 4.072 2.563 4.548 0.118 19 0 "[ . 1 . 2]" 1
1236 1 108 MET H 1 109 GLU H . . 4.660 2.635 2.169 2.969 . 0 0 "[ . 1 . 2]" 1
1237 1 108 MET QG 1 109 GLU H . . 4.790 3.983 2.602 4.624 . 0 0 "[ . 1 . 2]" 1
1238 1 109 GLU H 1 110 GLY H . . 4.750 2.693 2.279 3.241 . 0 0 "[ . 1 . 2]" 1
1239 1 109 GLU QB 1 111 THR H . . 5.340 3.053 2.377 4.292 . 0 0 "[ . 1 . 2]" 1
1240 1 110 GLY H 1 111 THR H . . 4.500 2.420 1.890 2.892 . 0 0 "[ . 1 . 2]" 1
1241 1 110 GLY QA 1 112 VAL QG . . 5.210 4.093 3.570 5.129 . 0 0 "[ . 1 . 2]" 1
1242 1 111 THR H 1 111 THR HB . . 3.690 2.853 2.648 3.587 . 0 0 "[ . 1 . 2]" 1
1243 1 111 THR H 1 111 THR MG . . 4.370 3.739 3.148 3.920 . 0 0 "[ . 1 . 2]" 1
1244 1 111 THR HA 1 111 THR MG . . 3.440 2.202 2.106 2.245 . 0 0 "[ . 1 . 2]" 1
1245 1 111 THR HA 1 112 VAL H . . 2.810 2.113 1.981 2.233 . 0 0 "[ . 1 . 2]" 1
1246 1 111 THR HB 1 112 VAL H . . 3.760 3.740 3.366 3.859 0.099 15 0 "[ . 1 . 2]" 1
1247 1 111 THR MG 1 112 VAL H . . 3.530 2.582 2.287 3.401 . 0 0 "[ . 1 . 2]" 1
1248 1 112 VAL H 1 112 VAL HB . . 3.700 2.515 2.290 2.794 . 0 0 "[ . 1 . 2]" 1
1249 1 112 VAL H 1 112 VAL MG1 . . 3.930 3.691 2.396 3.831 . 0 0 "[ . 1 . 2]" 1
1250 1 112 VAL H 1 112 VAL MG2 . . 3.930 2.666 2.363 3.913 . 0 0 "[ . 1 . 2]" 1
1251 1 112 VAL HA 1 112 VAL MG1 . . 3.520 2.466 2.355 3.229 . 0 0 "[ . 1 . 2]" 1
1252 1 112 VAL HA 1 112 VAL MG2 . . 3.520 2.347 2.235 2.441 . 0 0 "[ . 1 . 2]" 1
1253 1 112 VAL QG 1 113 SER H . . 3.810 2.537 2.394 2.722 . 0 0 "[ . 1 . 2]" 1
1254 1 112 VAL QG 1 114 LEU QD . . 4.780 1.955 1.750 2.146 . 0 0 "[ . 1 . 2]" 1
1255 1 113 SER H 1 113 SER HB2 . . 3.940 2.585 2.313 3.540 . 0 0 "[ . 1 . 2]" 1
1256 1 113 SER H 1 113 SER QB . . 3.350 2.367 2.206 2.774 . 0 0 "[ . 1 . 2]" 1
1257 1 113 SER H 1 113 SER HB3 . . 3.940 3.159 2.326 3.686 . 0 0 "[ . 1 . 2]" 1
1258 1 113 SER HA 1 114 LEU H . . 3.490 2.118 2.055 2.190 . 0 0 "[ . 1 . 2]" 1
1259 1 113 SER QB 1 114 LEU H . . 4.190 3.519 3.002 3.868 . 0 0 "[ . 1 . 2]" 1
1260 1 113 SER HB2 1 114 LEU H . . 4.790 4.227 3.580 4.394 . 0 0 "[ . 1 . 2]" 1
1261 1 113 SER HB3 1 114 LEU H . . 4.790 3.814 3.098 4.294 . 0 0 "[ . 1 . 2]" 1
1262 1 114 LEU H 1 114 LEU HB2 . . 3.770 2.466 2.283 2.689 . 0 0 "[ . 1 . 2]" 1
1263 1 114 LEU H 1 114 LEU MD1 . . 4.080 3.666 3.356 3.979 . 0 0 "[ . 1 . 2]" 1
1264 1 114 LEU H 1 114 LEU MD2 . . 4.080 2.387 2.082 3.203 . 0 0 "[ . 1 . 2]" 1
1265 1 114 LEU H 1 114 LEU HG . . 4.710 4.140 2.582 4.388 . 0 0 "[ . 1 . 2]" 1
1266 1 114 LEU H 1 115 LEU H . . 4.420 4.265 4.086 4.397 . 0 0 "[ . 1 . 2]" 1
1267 1 114 LEU HA 1 114 LEU QD . . 3.560 2.020 1.916 2.166 . 0 0 "[ . 1 . 2]" 1
1268 1 114 LEU HA 1 115 LEU H . . 3.520 2.179 2.089 2.255 . 0 0 "[ . 1 . 2]" 1
1269 1 114 LEU HB2 1 115 LEU H . . 5.240 4.237 3.918 4.355 . 0 0 "[ . 1 . 2]" 1
1270 1 114 LEU HB3 1 115 LEU H . . 4.610 3.422 3.057 3.569 . 0 0 "[ . 1 . 2]" 1
1271 1 114 LEU QD 1 115 LEU H . . 3.960 3.608 3.409 3.780 . 0 0 "[ . 1 . 2]" 1
1272 1 114 LEU MD1 1 115 LEU H . . 5.250 3.789 3.508 5.162 . 0 0 "[ . 1 . 2]" 1
1273 1 114 LEU MD2 1 115 LEU H . . 5.250 4.772 3.887 5.000 . 0 0 "[ . 1 . 2]" 1
1274 1 115 LEU H 1 116 VAL H . . 4.510 4.213 4.127 4.301 . 0 0 "[ . 1 . 2]" 1
1275 1 115 LEU HA 1 115 LEU QD . . 3.370 2.191 2.095 2.711 . 0 0 "[ . 1 . 2]" 1
1276 1 115 LEU HA 1 116 VAL H . . 3.210 2.084 2.029 2.177 . 0 0 "[ . 1 . 2]" 1
1277 1 115 LEU QB 1 116 VAL H . . 4.250 3.767 3.707 3.841 . 0 0 "[ . 1 . 2]" 1
1278 1 116 VAL H 1 116 VAL MG1 . . 4.080 2.818 2.716 2.937 . 0 0 "[ . 1 . 2]" 1
1279 1 116 VAL H 1 116 VAL MG2 . . 3.330 2.128 2.074 2.188 . 0 0 "[ . 1 . 2]" 1
1280 1 116 VAL H 1 117 PHE H . . 4.580 4.416 4.367 4.511 . 0 0 "[ . 1 . 2]" 1
1281 1 116 VAL HA 1 116 VAL MG1 . . 3.740 2.349 2.285 2.414 . 0 0 "[ . 1 . 2]" 1
1282 1 116 VAL HA 1 116 VAL MG2 . . 3.740 3.219 3.208 3.233 . 0 0 "[ . 1 . 2]" 1
1283 1 116 VAL HB 1 117 PHE H . . 3.970 2.493 2.343 2.841 . 0 0 "[ . 1 . 2]" 1
1284 1 116 VAL MG1 1 117 PHE H . . 4.090 3.632 3.535 3.765 . 0 0 "[ . 1 . 2]" 1
1285 1 116 VAL MG2 1 117 PHE H . . 4.220 3.523 3.298 3.776 . 0 0 "[ . 1 . 2]" 1
1286 1 116 VAL MG2 1 118 ARG H . . 4.950 4.053 3.696 4.377 . 0 0 "[ . 1 . 2]" 1
1287 1 117 PHE H 1 117 PHE QB . . 3.840 2.439 2.343 2.587 . 0 0 "[ . 1 . 2]" 1
1288 1 117 PHE HA 1 118 ARG H . . 3.340 2.062 1.997 2.168 . 0 0 "[ . 1 . 2]" 1
1289 1 117 PHE QB 1 118 ARG H . . 4.470 3.786 3.668 3.864 . 0 0 "[ . 1 . 2]" 1
1290 1 117 PHE QD 1 118 ARG H . . 4.660 3.670 3.329 3.902 . 0 0 "[ . 1 . 2]" 1
1291 1 117 PHE QE 1 118 ARG H . . 5.450 4.814 4.500 5.020 . 0 0 "[ . 1 . 2]" 1
1292 1 118 ARG H 1 118 ARG HB2 . . 3.820 2.962 2.363 3.744 . 0 0 "[ . 1 . 2]" 1
1293 1 118 ARG HA 1 118 ARG QD . . 4.040 3.882 2.099 4.166 0.126 6 0 "[ . 1 . 2]" 1
1294 1 118 ARG HA 1 118 ARG HE . . 4.840 3.983 1.965 4.873 0.033 16 0 "[ . 1 . 2]" 1
1295 1 118 ARG HA 1 119 GLN H . . 3.360 2.066 1.969 2.199 . 0 0 "[ . 1 . 2]" 1
1296 1 118 ARG HB2 1 118 ARG HD2 . . 3.910 3.060 2.271 3.667 . 0 0 "[ . 1 . 2]" 1
1297 1 118 ARG HB2 1 118 ARG QD . . 3.330 2.691 2.214 3.399 0.069 9 0 "[ . 1 . 2]" 1
1298 1 118 ARG HB2 1 118 ARG HD3 . . 3.910 3.337 2.418 4.059 0.149 9 0 "[ . 1 . 2]" 1
1299 1 118 ARG HB2 1 118 ARG HE . . 3.600 2.614 1.827 3.818 0.218 3 0 "[ . 1 . 2]" 1
1300 1 118 ARG HB2 1 119 GLN H . . 3.960 3.965 3.355 4.081 0.121 17 0 "[ . 1 . 2]" 1
1301 1 119 GLN H 1 119 GLN QB . . 3.310 2.580 2.259 3.098 . 0 0 "[ . 1 . 2]" 1
1302 1 119 GLN H 1 119 GLN QG . . 4.040 3.077 2.007 4.067 0.027 14 0 "[ . 1 . 2]" 1
1303 1 119 GLN HA 1 119 GLN QG . . 3.740 2.932 2.418 3.555 . 0 0 "[ . 1 . 2]" 1
1304 1 119 GLN QB 1 119 GLN QG . . 2.360 2.072 1.992 2.093 . 0 0 "[ . 1 . 2]" 1
1305 1 120 GLU HA 1 121 ASP H . . 3.010 2.260 2.040 2.952 . 0 0 "[ . 1 . 2]" 1
1306 1 120 GLU QB 1 121 ASP H . . 3.840 3.329 1.891 3.924 0.084 17 0 "[ . 1 . 2]" 1
1307 1 120 GLU HB2 1 121 ASP H . . 4.470 4.064 2.893 4.442 . 0 0 "[ . 1 . 2]" 1
1308 1 120 GLU HB3 1 121 ASP H . . 4.470 3.615 1.909 4.398 . 0 0 "[ . 1 . 2]" 1
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